Compile Data Set for Download or QSAR
maximum 50k data
Found 56 Enz. Inhib. hit(s) with all data for entry = 50040832
TargetProthrombin(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400807(CHEMBL2204324)
Affinity DataKi:  0.0900nMAssay Description:Inhibition of thrombinMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProthrombin(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50066331((S)-1-[(R)-2-Cyclohexyl-2-(diethylcarbamoylmethyl-...)
Affinity DataKi:  0.310nMAssay Description:Inhibition of thrombinMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProthrombin(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50331669((6R,21AS)-17-CHLORO-6-CYCLOHEXYL-2,3,6,7,10,11,19,...)
Affinity DataKi:  0.400nMAssay Description:Inhibition of thrombinMore data for this Ligand-Target Pair
TargetProthrombin(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400806(CHEMBL2204325)
Affinity DataKi:  0.400nMAssay Description:Inhibition of thrombinMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProthrombin(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50131468((S)-24-Chloro-11-(R)-cyclohexyl-20-oxa-3,9,12,17-t...)
Affinity DataKi:  0.400nMAssay Description:Inhibition of thrombinMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProthrombin(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50131463((6S,12R)-25-Chloro-11-cyclohexyl-21-oxa-3,9,12,18-...)
Affinity DataKi:  0.400nMAssay Description:Inhibition of thrombinMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetGrowth hormone secretagogue receptor type 1(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50359261(CHEMBL1923617)
Affinity DataKi:  1nMAssay Description:Agonist activity at ghrelin receptor by cell based assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetGrowth hormone secretagogue receptor type 1(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50359282(CHEMBL1923609)
Affinity DataKi:  6nMAssay Description:Agonist activity at ghrelin receptor by cell based assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetGrowth hormone secretagogue receptor type 1(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400799(CHEMBL2203623)
Affinity DataKi:  100nMAssay Description:Agonist activity at ghrelin receptorMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProthrombin(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50118723(CHEMBL342672 | CYCLOTHEONAMIDE A | N-[14-Benzyl-18...)
Affinity DataKi:  180nMAssay Description:Inhibition of thrombinMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetRenin(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400811(CHEMBL2204329)
Affinity DataIC50:  0.290nMAssay Description:Inhibition of reninMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetNeprilysin(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400808(CHEMBL2204326)
Affinity DataIC50:  0.800nMAssay Description:Inhibition of neutral endopeptidaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCyclin-dependent kinase 1(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400801(CHEMBL215803)
Affinity DataIC50:  1nMAssay Description:Inhibition of CDK1More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCyclin-dependent kinase 2(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400801(CHEMBL215803)
Affinity DataIC50:  1nMAssay Description:Inhibition of CDK2More data for this Ligand-Target Pair
In DepthDetails ArticlePubMedMMDB

TargetCyclin-dependent kinase 1(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400801(CHEMBL215803)
Affinity DataIC50:  1nMAssay Description:Inhibition of CDK4More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCyclin-dependent kinase 1(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400801(CHEMBL215803)
Affinity DataIC50:  1nMAssay Description:Inhibition of CDK6More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetRenin(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400813(CHEMBL2204327)
Affinity DataIC50:  1.30nMAssay Description:Inhibition of reninMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetBeta-secretase 1(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400805(CHEMBL2204316)
Affinity DataIC50:  1.60nMAssay Description:Inhibition of BACE1More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetNeprilysin(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50056251((6R,9S)-6-Mercaptomethyl-7-oxo-5,6,7,8,9,10,11,12,...)
Affinity DataIC50:  3nMAssay Description:Inhibition of neutral endopeptidaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAngiotensin-converting enzyme(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50056258((3R,6S)-3-Mercaptomethyl-4-oxo-5-aza-bicyclo[10.3....)
Affinity DataIC50:  4nMAssay Description:Inhibition of ACEMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetNeprilysin(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50056258((3R,6S)-3-Mercaptomethyl-4-oxo-5-aza-bicyclo[10.3....)
Affinity DataIC50:  8nMAssay Description:Inhibition of neutral endopeptidaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetC-X-C chemokine receptor type 4(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50035696(1,1''-{1,4-phenylenebis(methylene)}-bis{1,4,8,11-t...)
Affinity DataIC50:  12nMAssay Description:Antagonist activity at CXCR4More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetC-X-C chemokine receptor type 4(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50270276(CHEMBL477121 | N-[1,4,8,11-Tetraazacyclotetradecan...)
Affinity DataIC50:  12nMAssay Description:Antagonist activity at CXCR4More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCyclin-dependent kinase 1(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400802(CHEMBL1235529)
Affinity DataIC50:  20nMAssay Description:Inhibition of CDK1More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetBeta-secretase 1(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50212189(2-((5R,14R)-5-amino-5-methyl-4,16-dioxo-14-phenyl-...)
Affinity DataIC50:  27nMAssay Description:Inhibition of BACE1More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetBeta-secretase 1(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400804(CHEMBL2203629)
Affinity DataIC50:  27nMAssay Description:Inhibition of BACE1More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetVascular endothelial growth factor receptor 2(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400802(CHEMBL1235529)
Affinity DataIC50:  40nMAssay Description:Inhibition of VEGFR2More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetRenin(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400812(CHEMBL2204328)
Affinity DataIC50:  56nMAssay Description:Inhibition of reninMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetBeta-secretase 1(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM15799(CHEMBL81671 | Macrocyclic BACE inhibitor 1 | tert-...)
Affinity DataIC50:  82nMAssay Description:Inhibition of BACE1More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCyclin-dependent kinase 1(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400803(CHEMBL2203628)
Affinity DataIC50:  100nMAssay Description:Inhibition of CDK1More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCyclin-dependent kinase 2(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400803(CHEMBL2203628)
Affinity DataIC50:  100nMAssay Description:Inhibition of CDK2More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCyclin-dependent kinase 2(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400802(CHEMBL1235529)
Affinity DataIC50:  140nMAssay Description:Inhibition of CDK2More data for this Ligand-Target Pair
TargetGrowth hormone secretagogue receptor type 1(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400799(CHEMBL2203623)
Affinity DataIC50:  500nMAssay Description:Antagonist activity at ghrelin receptor assessed as inhibition of ghrelin-induced Ca2+ release by cell based assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetRenin(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50003187(CHEMBL92538 | [1-(4-Cyclohexylmethyl-3-hydroxy-2,6...)
Affinity DataIC50:  590nMAssay Description:Inhibition of reninMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetGrowth factor receptor-bound protein 2(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50139762(CHEMBL349373 | [(16R,20S)-18-((S)-Carbamoylmethyl)...)
Affinity DataIC50:  630nMAssay Description:Inhibition of SH2 domain of GRB2 in human MDA-MB-453 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A3(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400797(CHEMBL2203622)
Affinity DataIC50:  850nMAssay Description:Antagonist activity at adenosine A3 receptorMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetD(1A) dopamine receptor(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400797(CHEMBL2203622)
Affinity DataIC50:  1.10E+3nMAssay Description:Antagonist activity at dopamine D1 receptorMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetBeta-secretase 1(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM15799(CHEMBL81671 | Macrocyclic BACE inhibitor 1 | tert-...)
Affinity DataIC50:  2.10E+3nMAssay Description:Inhibition of BACE1 by cell based assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetRenin(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400810(CHEMBL2204330)
Affinity DataIC50:  2.70E+3nMAssay Description:Inhibition of reninMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHigh affinity choline transporter 1(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400797(CHEMBL2203622)
Affinity DataIC50:  3.20E+3nMAssay Description:Antagonist activity at CHT1More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHigh affinity nerve growth factor receptor(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400798(CHEMBL336015)
Affinity DataIC50:  4.00E+3nMAssay Description:Inhibition of TrkA assessed as inhibition of mAb5C3 bindingMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAngiotensin-converting enzyme(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50056251((6R,9S)-6-Mercaptomethyl-7-oxo-5,6,7,8,9,10,11,12,...)
Affinity DataIC50:  8.00E+3nMAssay Description:Inhibition of ACEMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetGrowth factor receptor-bound protein 2(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50139762(CHEMBL349373 | [(16R,20S)-18-((S)-Carbamoylmethyl)...)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of SH2 domain of GRB2 in human MDA-MB-231 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetRenin(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400809(CHEMBL2204331)
Affinity DataIC50:  6.90E+4nMAssay Description:Inhibition of reninMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetRenin(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50400814(CHEMBL2204332)
Affinity DataIC50: >1.00E+5nMAssay Description:Inhibition of reninMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetGrowth hormone secretagogue receptor type 1(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50359255(CHEMBL1923501)
Affinity DataEC50:  68nMAssay Description:Agonist activity at ghrelin receptor by cell based assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetGrowth hormone secretagogue receptor type 1(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50359256(CHEMBL1923502 | ULIMORELIN)
Affinity DataEC50:  27nMAssay Description:Agonist activity at ghrelin receptor by cell based assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSonic hedgehog protein(Mus musculus (Mouse))
Universite£

Curated by ChEMBL
LigandPNGBDBM50249181(CHEMBL473392 | N-(4-chlorobenzyl)-2-((2R,6S,E)-5,1...)
Affinity DataEC50:  4.00E+3nMAssay Description:Inhibition of sonic hedgehog pathway in mouse NIH-3T3 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDnaJ homolog subfamily A member 1(Homo sapiens (Human))
Universite£

Curated by ChEMBL
LigandPNGBDBM50139187(4-(2-cyclohexylethyl)-23-oxo-8-oxa-1,15,17,21-tetr...)
Affinity DataEC50:  12nMAssay Description:Inhibition of HDJ2More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetRas-related protein Rap-1A(Homo sapiens (Human))
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Curated by ChEMBL
LigandPNGBDBM50139187(4-(2-cyclohexylethyl)-23-oxo-8-oxa-1,15,17,21-tetr...)
Affinity DataEC50:  140nMAssay Description:Inhibition of Rap1aMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
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