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Record - 1 of 20   [TOP]
Compound IDNVIC0001
Compound Structure
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InhibitorGS-441524
PubChem ID 56832906
Drug Bank ID
ChemSpider ID 28499861
SMILESC1=C2C(=NC=NN2C(=C1)C3(C(C(C(O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O)C#N)N
Molecular Weight (in g/mol)531.202
TargetRNA dependent RNA Polymerase
Assay TypeReporter Virus assay
Assay DescriptionFour-parameter variable slope non-linear regression fitting
Assay Source
Cell TypeHeLa or 293?T/17 cells
OutcomeInhibition of transcription in NiV (Rec. M-Luc2AM)
IC50 (in nM)
EC50 (in nM)490
H-bond Acceptor10
H-bond Donor3
No. of Rotatable Bond Count8
XLogP-6.1
PSA330.26
Reference(s)https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5338263/
PubMed ID [Source Literature] 28262699
Curatoranshu@imtech.res.in

                  
Record - 2 of 20   [TOP]
Compound IDNVIC0002
Compound Structure
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InhibitorGS-5734
PubChem ID 121304016
Drug Bank IDDB14761
ChemSpider ID 58827832
SMILESCCC(CC)COC(=O)C(C)NP(=O)(OCC1C(C(C(O1)(C#N)C2=CC=C3N2N=CN=C3N)O)O)OC4=CC=CC=C4
Molecular Weight (in g/mol)602.585
TargetRNA dependent RNA Polymerase
Assay TypeReporter Virus assay
Assay DescriptionFour-parameter variable slope non-linear regression fitting
Assay SourceGS-5734 were synthesized at Gilead Sciences, Inc.
Cell TypeHeLa or 293?T/17 cells
OutcomeInhibition of transcription in NiV (Rec. M-Luc2AM)
IC50 (in nM)
EC50 (in nM)45
H-bond Acceptor10
H-bond Donor4
No. of Rotatable Bond Count14
XLogP2.1
PSA213.36
Reference(s)https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5338263/
PubMed ID [Source Literature] 28262699
Curatoranshu@imtech.res.in

                  
Record - 3 of 20   [TOP]
Compound IDNVIC0002
Compound Structure
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InhibitorGS-5734
PubChem ID 121304016
Drug Bank IDDB14761
ChemSpider ID 58827832
SMILESCCC(CC)COC(=O)C(C)NP(=O)(OCC1C(C(C(O1)(C#N)C2=CC=C3N2N=CN=C3N)O)O)OC4=CC=CC=C4
Molecular Weight (in g/mol)602.585
TargetRNA dependent RNA Polymerase
Assay TypeReporter Virus assay
Assay DescriptionFour-parameter variable slope non-linear regression fitting
Assay SourceGS-5734 were synthesized at Gilead Sciences, Inc.
Cell TypeHeLa or 293?T/17 cells
OutcomeInhibition of transcription in NiV (Rec. M-GFP2AM)
IC50 (in nM)
EC50 (in nM)29
H-bond Acceptor10
H-bond Donor4
No. of Rotatable Bond Count14
XLogP2.1
PSA213.36
Reference(s)https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5338263/
PubMed ID [Source Literature] 28262699
Curatorpriyankapaul008@gmail.com

                  
Record - 4 of 20   [TOP]
Compound IDNVIC0002
Compound Structure
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InhibitorGS-5734
PubChem ID 121304016
Drug Bank IDDB14761
ChemSpider ID 58827832
SMILESCCC(CC)COC(=O)C(C)NP(=O)(OCC1C(C(C(O1)(C#N)C2=CC=C3N2N=CN=C3N)O)O)OC4=CC=CC=C4
Molecular Weight (in g/mol)602.585
TargetRNA dependent RNA Polymerase
Assay TypeVirus titer reduction assay
Assay DescriptionFour-parameter variable slope non-linear regression fitting
Assay SourceGS-5734 were synthesized at Gilead Sciences, Inc.
Cell TypeHeLa cells
OutcomeInhibition of replication in NiV (M-1999)
IC50 (in nM)
EC50 (in nM)47
H-bond Acceptor10
H-bond Donor4
No. of Rotatable Bond Count14
XLogP2.1
PSA213.36
Reference(s)https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5338263/
PubMed ID [Source Literature] 28262699
Curatorpriyankapaul008@gmail.com

                  
Record - 5 of 20   [TOP]
Compound IDNVIC0002
Compound Structure
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InhibitorGS-5734
PubChem ID 121304016
Drug Bank IDDB14761
ChemSpider ID 58827832
SMILESCCC(CC)COC(=O)C(C)NP(=O)(OCC1C(C(C(O1)(C#N)C2=CC=C3N2N=CN=C3N)O)O)OC4=CC=CC=C4
Molecular Weight (in g/mol)602.585
TargetRNA dependent RNA Polymerase
Assay TypeVirus titer reduction assay / cytopathic effect assay
Assay DescriptionFour-parameter variable slope non-linear regression fitting
Assay SourceGS-5734 were synthesized at Gilead Sciences, Inc.
Cell TypeHeLa or H358 cells
OutcomeInhibition of replication in NiV (B-2004) or Inhibition of virus-induced CPE
IC50 (in nM)
EC50 (in nM)32
H-bond Acceptor10
H-bond Donor4
No. of Rotatable Bond Count14
XLogP2.1
PSA213.36
Reference(s)https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5338263/
PubMed ID [Source Literature] 28262699
Curatorpriyankapaul008@gmail.com

                  
Record - 6 of 20   [TOP]
Compound IDNVIC0003
Compound Structure
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InhibitorR1479
PubChem ID 457388
Drug Bank ID
ChemSpider ID 402579
SMILESC1=CN(C(=O)N=C1N)C2C(C(C(O2)(CO)N=[N+]=[N-])O)O
Molecular Weight (in g/mol)284.232
TargetRNA dependent RNA Polymerase
Assay TypeReporter Virus assay
Assay DescriptionDose-response data fitted to a 4-parameter logistic curve
Assay SourceCarbosynth US LLC, San Diego, CA, USA
Cell TypeNCI-H358 cells
OutcomeInhibition of transcription in NiV-Luc2AM
IC50 (in nM)
EC50 (in nM)1120
H-bond Acceptor7
H-bond Donor4
No. of Rotatable Bond Count3
XLogP-2.1
PSA140.97
Reference(s)https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5648002/
PubMed ID [Source Literature] 28629988
Curatoranshu@imtech.res.in

                  
Record - 7 of 20   [TOP]
Compound IDNVIC0003
Compound Structure
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InhibitorR1479
PubChem ID 457388
Drug Bank ID
ChemSpider ID 402579
SMILESC1=CN(C(=O)N=C1N)C2C(C(C(O2)(CO)N=[N+]=[N-])O)O
Molecular Weight (in g/mol)284.232
TargetRNA dependent RNA Polymerase
Assay TypeCytopathic effect assay
Assay DescriptionDose-response data fitted to a 4-parameter logistic curve
Assay SourceCarbosynth US LLC, San Diego, CA, USA
Cell TypeNCI-H358 cells
OutcomeReduction in cell viability
IC50 (in nM)
EC50 (in nM)2630
H-bond Acceptor7
H-bond Donor4
No. of Rotatable Bond Count3
XLogP-2.1
PSA140.97
Reference(s)https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5648002/
PubMed ID [Source Literature] 28629988
Curatorkanikatuteja@gmail.com

                  
Record - 8 of 20   [TOP]
Compound IDNVIC0003
Compound Structure
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InhibitorR1479
PubChem ID 457388
Drug Bank ID
ChemSpider ID 402579
SMILESC1=CN(C(=O)N=C1N)C2C(C(C(O2)(CO)N=[N+]=[N-])O)O
Molecular Weight (in g/mol)284.232
TargetRNA dependent RNA Polymerase
Assay TypeCytopathic effect assay
Assay DescriptionDose-response data fitted to a 4-parameter logistic curve
Assay SourceCarbosynth US LLC, San Diego, CA, USA
Cell TypeHeLa
OutcomeReduction in cell viability
IC50 (in nM)
EC50 (in nM)13550
H-bond Acceptor7
H-bond Donor4
No. of Rotatable Bond Count3
XLogP-2.1
PSA140.97
Reference(s)https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5648002/
PubMed ID [Source Literature] 28629988
Curatorkanikatuteja@gmail.com

                  
Record - 9 of 20   [TOP]
Compound IDNVIC0003
Compound Structure
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InhibitorR1479
PubChem ID 457388
Drug Bank ID
ChemSpider ID 402579
SMILESC1=CN(C(=O)N=C1N)C2C(C(C(O2)(CO)N=[N+]=[N-])O)O
Molecular Weight (in g/mol)284.232
TargetRNA dependent RNA Polymerase
Assay TypeVirus titer reduction assay
Assay DescriptionVisually inquired for CPE
Assay SourceCarbosynth US LLC, San Diego, CA, USA
Cell TypeNCI-H358 cells
OutcomeReduction in cell viability
IC50 (in nM)
EC50 (in nM)1530
H-bond Acceptor7
H-bond Donor4
No. of Rotatable Bond Count3
XLogP-2.1
PSA140.97
Reference(s)https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5648002/
PubMed ID [Source Literature] 28629988
Curatorkanikatuteja@gmail.com

                  
Record - 10 of 20   [TOP]
Compound IDNVIC0003
Compound Structure
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InhibitorR1479
PubChem ID 457388
Drug Bank ID
ChemSpider ID 402579
SMILESC1=CN(C(=O)N=C1N)C2C(C(C(O2)(CO)N=[N+]=[N-])O)O
Molecular Weight (in g/mol)284.232
TargetRNA dependent RNA Polymerase
Assay TypeReporter Virus assay
Assay DescriptionDose-response data fitted to a 4-parameter logistic curve
Assay SourceCarbosynth US LLC, San Diego, CA, USA
Cell TypeHeLa
OutcomeInhibition of transcription in NiV-Luc2AM
IC50 (in nM)
EC50 (in nM)5680
H-bond Acceptor7
H-bond Donor4
No. of Rotatable Bond Count3
XLogP-2.1
PSA140.97
Reference(s)https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5648002/
PubMed ID [Source Literature] 28629988
Curatorpriyankapaul008@gmail.com

                  
Record - 11 of 20   [TOP]
Compound IDNVIC0003
Compound Structure
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InhibitorR1479
PubChem ID 457388
Drug Bank ID
ChemSpider ID 402579
SMILESC1=CN(C(=O)N=C1N)C2C(C(C(O2)(CO)N=[N+]=[N-])O)O
Molecular Weight (in g/mol)284.232
TargetRNA dependent RNA Polymerase
Assay TypeReporter Virus assay
Assay DescriptionDose-response data fitted to a 4-parameter logistic curve
Assay SourceCarbosynth US LLC, San Diego, CA, USA
Cell TypeNCI-H358 cells
OutcomeInhibition of transcription in NiV-GFP2AM
IC50 (in nM)
EC50 (in nM)1640
H-bond Acceptor7
H-bond Donor4
No. of Rotatable Bond Count3
XLogP-2.1
PSA140.97
Reference(s)https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5648002/
PubMed ID [Source Literature] 28629988
Curatorpriyankapaul008@gmail.com

                  
Record - 12 of 20   [TOP]
Compound IDNVIC0003
Compound Structure
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InhibitorR1479
PubChem ID 457388
Drug Bank ID
ChemSpider ID 402579
SMILESC1=CN(C(=O)N=C1N)C2C(C(C(O2)(CO)N=[N+]=[N-])O)O
Molecular Weight (in g/mol)284.232
TargetRNA dependent RNA Polymerase
Assay TypeVirus titer reduction assay
Assay DescriptionVisually assayed for CPE
Assay SourceCarbosynth US LLC, San Diego, CA, USA
Cell TypeHeLa
OutcomeReplication inhibition in wild type NiV
IC50 (in nM)
EC50 (in nM)4000
H-bond Acceptor7
H-bond Donor4
No. of Rotatable Bond Count3
XLogP-2.1
PSA140.97
Reference(s)https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5648002/
PubMed ID [Source Literature] 28629988
Curatorpriyankapaul008@gmail.com

                  
Record - 13 of 20   [TOP]
Compound IDNVIC0004
Compound Structure
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InhibitorFavipiravir
PubChem ID 492405
Drug Bank IDDB12466
ChemSpider ID 431002
SMILESC1=C(N=C(C(=O)N1)C(=O)N)F
Molecular Weight (in g/mol)157.104
TargetRNA dependent RNA Polymerase
Assay TypeVirus yield reduction assay
Assay DescriptionPlaque assay
Assay SourceToyama Chemical Company, Ltd. (Toyama, Japan)
Cell TypeVero CCL81 cells
OutcomeReduction of viral titres in a dose-dependent manner for NiV-Malaysia (NiV-M)
IC50 (in nM)
EC50 (in nM)44240
H-bond Acceptor4
H-bond Donor2
No. of Rotatable Bond Count1
XLogP-0.3
PSA89.10
Reference(s)https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5954062/
PubMed ID [Source Literature] 29765101
Curatoranshu@imtech.res.in

                  
Record - 14 of 20   [TOP]
Compound IDNVIC0004
Compound Structure
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InhibitorFavipiravir
PubChem ID 492405
Drug Bank IDDB12466
ChemSpider ID 431002
SMILESC1=C(N=C(C(=O)N1)C(=O)N)F
Molecular Weight (in g/mol)157.104
TargetRNA dependent RNA Polymerase
Assay TypeVirus yield reduction assay
Assay DescriptionPlaque assay
Assay SourceToyama Chemical Company, Ltd. (Toyama, Japan)
Cell TypeVero CCL81 cells
OutcomeReduction of viral titres in a dose-dependent manner for NiV-Bangladesh (NiV-B)
IC50 (in nM)
EC50 (in nM)14820
H-bond Acceptor4
H-bond Donor2
No. of Rotatable Bond Count1
XLogP-0.3
PSA89.10
Reference(s)https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5954062/
PubMed ID [Source Literature] 29765101
Curatoranshu@imtech.res.in

                  
Record - 15 of 20   [TOP]
Compound IDNVIC0004
Compound Structure
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InhibitorFavipiravir
PubChem ID 492405
Drug Bank IDDB12466
ChemSpider ID 431002
SMILESC1=C(N=C(C(=O)N1)C(=O)N)F
Molecular Weight (in g/mol)157.104
TargetRNA dependent RNA Polymerase
Assay TypeVirus yield reduction assay
Assay DescriptionPlaque assay
Assay SourceToyama Chemical Company, Ltd. (Toyama, Japan)
Cell TypeVero CCL81 cells
OutcomeReduction of viral titres in a dose-dependent manner for recombinant NiV expressing Gaussia luciferase and eGFP (rNiV-Gluc-eGFP)
IC50 (in nM)
EC50 (in nM)14570
H-bond Acceptor4
H-bond Donor2
No. of Rotatable Bond Count1
XLogP-0.3
PSA89.10
Reference(s)https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5954062/
PubMed ID [Source Literature] 29765101
Curatoranshu@imtech.res.in

                  
Record - 16 of 20   [TOP]
Compound IDNVIC0035
Compound Structure
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InhibitorRSV604
PubChem ID 5279172
Drug Bank ID
ChemSpider ID 4442963
SMILESC1=CC=C(C=C1)C2=NC(C(=O)NC3=CC=CC=C32)NC(=O)NC4=CC=CC=C4F
Molecular Weight (in g/mol)388.402
TargetRNA dependent RNA Polymerase
Assay Type
Assay Description
Assay Source
Cell Type
Outcome
IC50 (in nM)
EC50 (in nM)
H-bond Acceptor6
H-bond Donor3
No. of Rotatable Bond Count5
XLogP6.03
PSA82.59
Reference(s)https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4428208/
PubMed ID [Source Literature] 26029193
Curatornishisharmacool14@gmail.com

                  
Record - 17 of 20   [TOP]
Compound IDNVIC0098
Compound Structure
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InhibitorGS-441524 (Nuc)
PubChem ID 44468216
Drug Bank IDDB15686
ChemSpider ID 28499294
SMILESC1=C2C(=NC=NN2C(=C1)C3(C(C(C(O3)CO)O)O)C#N)N
Molecular Weight (in g/mol)291.267
TargetRNA dependent RNA Polymerase
Assay TypeReporter Virus assay
Assay DescriptionFour-parameter variable slope non-linear regression fitting
Assay SourceGS-441524 (Nuc) were synthesized at Gilead Sciences, Inc.
Cell TypeHeLa or 293?T/17 cells
OutcomeInhibition of transcription in NiV (Rec. M-Luc2AM)
IC50 (in nM)
EC50 (in nM)1500
H-bond Acceptor5
H-bond Donor4
No. of Rotatable Bond Count2
XLogP-2
PSA149.92
Reference(s)https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5338263/
PubMed ID [Source Literature] 28262699
Curatorpriyankapaul008@gmail.com

                  
Record - 18 of 20   [TOP]
Compound IDNVIC0098
Compound Structure
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InhibitorGS-441524 (Nuc)
PubChem ID 44468216
Drug Bank IDDB15686
ChemSpider ID 28499294
SMILESC1=C2C(=NC=NN2C(=C1)C3(C(C(C(O3)CO)O)O)C#N)N
Molecular Weight (in g/mol)291.267
TargetRNA dependent RNA Polymerase
Assay TypeReporter Virus assay
Assay DescriptionFour-parameter variable slope non-linear regression fitting
Assay SourceGS-441524 (Nuc) were synthesized at Gilead Sciences, Inc.
Cell TypeHeLa or 293?T/17 cells
OutcomeInhibition of transcription in NiV (Rec. M-GFP2AM)
IC50 (in nM)
EC50 (in nM)2200
H-bond Acceptor5
H-bond Donor4
No. of Rotatable Bond Count2
XLogP-2
PSA149.92
Reference(s)https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5338263/
PubMed ID [Source Literature] 28262699
Curatorpriyankapaul008@gmail.com

                  
Record - 19 of 20   [TOP]
Compound IDNVIC0098
Compound Structure
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InhibitorGS-441524 (Nuc)
PubChem ID 44468216
Drug Bank IDDB15686
ChemSpider ID 28499294
SMILESC1=C2C(=NC=NN2C(=C1)C3(C(C(C(O3)CO)O)O)C#N)N
Molecular Weight (in g/mol)291.267
TargetRNA dependent RNA Polymerase
Assay TypeVirus titer reduction assay (VTR)
Assay DescriptionFour-parameter variable slope non-linear regression fitting
Assay SourceGS-441524 (Nuc) were synthesized at Gilead Sciences, Inc.
Cell TypeHeLa cells
OutcomeInhibition of replication in NiV (M-1999)
IC50 (in nM)
EC50 (in nM)490
H-bond Acceptor5
H-bond Donor4
No. of Rotatable Bond Count2
XLogP-2
PSA149.92
Reference(s)https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5338263/
PubMed ID [Source Literature] 28262699
Curatorpriyankapaul008@gmail.com

                  
Record - 20 of 20   [TOP]
Compound IDNVIC0098
Compound Structure
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InhibitorGS-441524 (Nuc)
PubChem ID 44468216
Drug Bank IDDB15686
ChemSpider ID 28499294
SMILESC1=C2C(=NC=NN2C(=C1)C3(C(C(C(O3)CO)O)O)C#N)N
Molecular Weight (in g/mol)291.267
TargetRNA dependent RNA Polymerase
Assay TypeVirus titer reduction assay (VTR)/ cytopathic effect assay(CPE)
Assay DescriptionFour-parameter variable slope non-linear regression fitting
Assay SourceGS-441524 (Nuc) were synthesized at Gilead Sciences, Inc.
Cell TypeHeLa or H358 cells
OutcomeInhibition of replication in NiV (B-2004) or Inhibition of virus-induced CPE
IC50 (in nM)
EC50 (in nM)830
H-bond Acceptor5
H-bond Donor4
No. of Rotatable Bond Count2
XLogP-2
PSA149.92
Reference(s)https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5338263/
PubMed ID [Source Literature] 28262699
Curatorpriyankapaul008@gmail.com