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Record - 1 of 13   [TOP]
Compound IDNVIC0013
Compound Structure
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InhibitorKIN1408
SMILESCOC1=CC2=C(C=C1)SC(=N2)NC(C3=CC=C(C=C3)OC(F)F)C4=C(C5=C(C=CC=N5)C=C4)O
PubChem ID 119081414
Drug Bank ID\N
ChemSpider ID57251290
TargetActivation of IRF3-dependent innate immune responses
Assay TypeCPE visual
Assay DescriptionTwo-way analysis of variance with Bonferroni posttests
Assay SourceLife Chemicals Inc. and Kineta, Inc.
Cell TypeVero E6 cells
IC50 (nM)0.0
EC50 (in nM)0.0
OutcomeDecrease in the number of infectious virus particles
Molecular Weight (in g/mol)479.50
H-bond Acceptor7
H-bond Donor2
No. of Rotatable Bonds7
LogP5.47
Topological Polar Surface Area (Å)104.74
PUBMED ID26676770
Referencehttps://www.ncbi.nlm.nih.gov/pmc/articles/PMC4810700/
Curator Email IDkanikatuteja@gmail.com

                  
Record - 2 of 13   [TOP]
Compound IDNVIC0017
Compound Structure
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InhibitorPyrazofurin
SMILESC(C1C(C(C(O1)C2=NNC(=C2O)C(=O)N)O)O)O
PubChem ID 135413551
Drug Bank ID\N
ChemSpider ID10570780
TargetReplication
Assay TypeCPE visual
Assay Description\N
Assay Source\N
Cell TypeVero E6 cells
IC50 (nM)0.0
EC50 (in nM)0.0
OutcomeInhibition of viral replication
Molecular Weight (in g/mol)259.22
H-bond Acceptor8
H-bond Donor6
No. of Rotatable Bonds3
LogP-1.60
Topological Polar Surface Area (Å)161.92
PUBMED ID16641448
Referencehttps://www.ncbi.nlm.nih.gov/pmc/articles/PMC1472238/
Curator Email IDkanikatuteja@gmail.com

                  
Record - 3 of 13   [TOP]
Compound IDNVIC0054
Compound Structure
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InhibitorChloroquine
SMILESCCN(CC)CCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl
PubChem ID 2719
Drug Bank IDDB00608
ChemSpider ID2618
TargetRNA replication
Assay TypeCPE visual
Assay DescriptionNon-linear regression analysis
Assay SourceSigma
Cell TypeHeLa cells
IC50 (nM)620.0
EC50 (in nM)0.0
OutcomeReduce the spread and infection of NiV
Molecular Weight (in g/mol)319.88
H-bond Acceptor3
H-bond Donor1
No. of Rotatable Bonds8
LogP4.14
Topological Polar Surface Area (Å)28.16
PUBMED ID19889926
Referencehttps://www.ncbi.nlm.nih.gov/pmc/articles/PMC2888097/
Curator Email IDnishisharmacool14@gmail.com

                  
Record - 4 of 13   [TOP]
Compound IDNVIC0065
Compound Structure
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InhibitorRibavirin
SMILESC1=NC(=NN1C2C(C(C(O2)CO)O)O)C(=O)N
PubChem ID 37542
Drug Bank IDDB00811
ChemSpider ID34439
TargetReplication
Assay TypeCPE visual
Assay Description\N
Assay Source\N
Cell TypeVero E6 cells
IC50 (nM)0.0
EC50 (in nM)0.0
OutcomeInhibition of viral replication
Molecular Weight (in g/mol)244.21
H-bond Acceptor7
H-bond Donor4
No. of Rotatable Bonds3
LogP-3.00
Topological Polar Surface Area (Å)143.72
PUBMED ID16641448
Referencehttps://www.ncbi.nlm.nih.gov/pmc/articles/PMC1472238/
Curator Email IDkanikatuteja@gmail.com

                  
Record - 5 of 13   [TOP]
Compound IDNVIC0065
Compound Structure
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InhibitorRibavirin
SMILESC1=NC(=NN1C2C(C(C(O2)CO)O)O)C(=O)N
PubChem ID 37542
Drug Bank IDDB00811
ChemSpider ID34439
TargetRNA replication
Assay TypeCPE visual
Assay DescriptionNon-linear regression analysis
Assay SourceValeant
Cell TypeHeLa cells
IC50 (nM)4180.0
EC50 (in nM)0.0
OutcomeReduce the spread and infection of NiV
Molecular Weight (in g/mol)244.21
H-bond Acceptor7
H-bond Donor4
No. of Rotatable Bonds3
LogP-3.00
Topological Polar Surface Area (Å)143.72
PUBMED ID19889926
Referencehttps://www.ncbi.nlm.nih.gov/pmc/articles/PMC2888097/
Curator Email IDnishisharmacool14@gmail.com

                  
Record - 6 of 13   [TOP]
Compound IDNVIC0066
Compound Structure
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InhibitorBortezomib
SMILESB(C(CC(C)C)NC(=O)C(CC1=CC=CC=C1)NC(=O)C2=NC=CN=C2)(O)O
PubChem ID 387447
Drug Bank IDDB00188
ChemSpider ID343402
Targetmatrix protein (NiV-M)
Assay TypeCPE visual
Assay DescriptionVirus Titre Reduction assay
Assay SourceChemieTek
Cell TypeHeLa cells
IC50 (nM)2.7
EC50 (in nM)0.0
OutcomeInhibition of NiV infection.
Molecular Weight (in g/mol)384.24
H-bond Acceptor6
H-bond Donor4
No. of Rotatable Bonds11
LogP3.23
Topological Polar Surface Area (Å)124.44
PUBMED ID21085610
Referencehttps://www.ncbi.nlm.nih.gov/pmc/articles/PMC2978725/
Curator Email IDkanikatuteja@gmail.com

                  
Record - 7 of 13   [TOP]
Compound IDNVIC0078
Compound Structure
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InhibitorGS-441524 (Nuc)
SMILESC1=C2C(=NC=NN2C(=C1)C3(C(C(C(O3)CO)O)O)C#N)N
PubChem ID 44468216
Drug Bank IDDB15686
ChemSpider ID28499294
TargetRNA-dependent RNA polymerase (RdRp)
Assay TypeCPE visual
Assay DescriptionNon-linear regression analysis
Assay SourceGS-441524 (Nuc) were synthesized at Gilead Sciences, Inc.
Cell TypeHeLa cells
IC50 (nM)0.0
EC50 (in nM)490.0
OutcomeInhibition of replication in NiV (M-1999)
Molecular Weight (in g/mol)291.27
H-bond Acceptor5
H-bond Donor4
No. of Rotatable Bonds2
LogP-2.00
Topological Polar Surface Area (Å)149.92
PUBMED ID28262699
Referencehttps://www.ncbi.nlm.nih.gov/pmc/articles/PMC5338263/
Curator Email IDpriyankapaul008@gmail.com

                  
Record - 8 of 13   [TOP]
Compound IDNVIC0085
Compound Structure
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InhibitorEICAR
SMILESC#CC1=C(N=CN1C2C(C(C(O2)CO)O)O)C(=O)N
PubChem ID 453180
Drug Bank ID\N
ChemSpider ID399153
TargetReplication
Assay TypeCPE visual
Assay Description\N
Assay Source\N
Cell TypeVero E6 cells
IC50 (nM)0.0
EC50 (in nM)0.0
OutcomeInhibition of viral replication
Molecular Weight (in g/mol)267.24
H-bond Acceptor7
H-bond Donor5
No. of Rotatable Bonds3
LogP-1.80
Topological Polar Surface Area (Å)130.83
PUBMED ID16641448
Referencehttps://www.ncbi.nlm.nih.gov/pmc/articles/PMC1472238/
Curator Email IDkanikatuteja@gmail.com

                  
Record - 9 of 13   [TOP]
Compound IDNVIC0086
Compound Structure
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InhibitorR1479
SMILESC1=CN(C(=O)N=C1N)C2C(C(C(O2)(CO)N=[N+]=[N-])O)O
PubChem ID 457388
Drug Bank ID\N
ChemSpider ID402579
TargetRNA-dependent RNA polymerase (RdRp)
Assay TypeCPE visual
Assay DescriptionNon-linear regression analysis
Assay SourceCarbosynth US LLC, San Diego, CA, USA
Cell TypeHeLa cells
IC50 (nM)0.0
EC50 (in nM)13550.0
OutcomeReduction in cell viability
Molecular Weight (in g/mol)284.23
H-bond Acceptor7
H-bond Donor4
No. of Rotatable Bonds3
LogP-2.10
Topological Polar Surface Area (Å)140.97
PUBMED ID28629988
Referencehttps://www.ncbi.nlm.nih.gov/pmc/articles/PMC5648002/
Curator Email IDkanikatuteja@gmail.com

                  
Record - 10 of 13   [TOP]
Compound IDNVIC0086
Compound Structure
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InhibitorR1479
SMILESC1=CN(C(=O)N=C1N)C2C(C(C(O2)(CO)N=[N+]=[N-])O)O
PubChem ID 457388
Drug Bank ID\N
ChemSpider ID402579
TargetRNA-dependent RNA polymerase (RdRp)
Assay TypeCPE visual
Assay DescriptionVisually assayed for CPE
Assay SourceCarbosynth US LLC, San Diego, CA, USA
Cell TypeNCI-H358 cells
IC50 (nM)0.0
EC50 (in nM)1530.0
OutcomeReduction in cell viability
Molecular Weight (in g/mol)284.23
H-bond Acceptor7
H-bond Donor4
No. of Rotatable Bonds3
LogP-2.10
Topological Polar Surface Area (Å)140.97
PUBMED ID28629988
Referencehttps://www.ncbi.nlm.nih.gov/pmc/articles/PMC5648002/
Curator Email IDkanikatuteja@gmail.com

                  
Record - 11 of 13   [TOP]
Compound IDNVIC0088
Compound Structure
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InhibitorMG132
SMILESCC(C)CC(C=O)NC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)OCC1=CC=CC=C1
PubChem ID 462382
Drug Bank ID\N
ChemSpider ID406728
Targetmatrix protein (NiV-M)
Assay TypeCPE visual
Assay DescriptionVirus Titre Reduction assay
Assay SourceCalbiochem
Cell TypeHeLa cells
IC50 (nM)0.5
EC50 (in nM)0.0
OutcomeReduction in viral titers
Molecular Weight (in g/mol)475.63
H-bond Acceptor8
H-bond Donor3
No. of Rotatable Bonds18
LogP6.81
Topological Polar Surface Area (Å)113.60
PUBMED ID21085610
Referencehttps://www.ncbi.nlm.nih.gov/pmc/articles/PMC2978725/
Curator Email IDkanikatuteja@gmail.com

                  
Record - 12 of 13   [TOP]
Compound IDNVIC0089
Compound Structure
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InhibitorGYY4137[morpholin-4-ium-4-methoxyphenyl(morpholino)phosphinodithioate]
SMILESCOC1=CC=C(C=C1)P(=S)(N2CCOCC2)S
PubChem ID 46937262
Drug Bank ID\N
ChemSpider ID26232138
TargetViral replication and proinflammatory gene expression.
Assay TypeCPE visual
Assay DescriptionPlaque assay
Assay SourceSigma-Aldrich (St. Louis, MO, USA)
Cell TypeSAE cells
IC50 (nM)0.0
EC50 (in nM)0.0
OutcomeReplication and inflammatory chemokine production induced by Nipah virus (NiV-B) was inhibited
Molecular Weight (in g/mol)289.35
H-bond Acceptor3
H-bond Donor0
No. of Rotatable Bonds3
LogP2.58
Topological Polar Surface Area (Å)63.60
PUBMED ID25740991
Referencehttps://www.ncbi.nlm.nih.gov/pmc/articles/PMC4442521/
Curator Email IDnishisharmacool14@gmail.com

                  
Record - 13 of 13   [TOP]
Compound IDNVIC0110
Compound Structure
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Inhibitor6-Azauridine
SMILESC1=NN(C(=O)NC1=O)C2C(C(C(O2)CO)O)O
PubChem ID 5901
Drug Bank ID\N
ChemSpider ID203593
TargetReplication
Assay TypeCPE visual
Assay Description\N
Assay Source\N
Cell TypeVero E6 cells
IC50 (nM)0.0
EC50 (in nM)0.0
OutcomeInhibition of viral replication
Molecular Weight (in g/mol)245.19
H-bond Acceptor8
H-bond Donor4
No. of Rotatable Bonds2
LogP-1.90
Topological Polar Surface Area (Å)131.69
PUBMED ID16641448
Referencehttps://www.ncbi.nlm.nih.gov/pmc/articles/PMC1472238/
Curator Email IDkanikatuteja@gmail.com