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BDBM50135948 2-(4-Methoxy-phenyl)-5-methyl-2H-pyrazole-3-carboxylic acid [5-(2-sulfamoyl-phenyl)-pyridin-2-yl]-amide::CHEMBL146982

SMILES: COc1ccc(cc1)-n1nc(C)cc1C(=O)Nc1ccc(cn1)-c1ccccc1S(N)(=O)=O

InChI Key: InChIKey=GIBFSRBTDFHVKQ-UHFFFAOYSA-N

Data: 3 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50135948   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Coagulation factor X


(Homo sapiens (Human))
BDBM50135948
PNG
(2-(4-Methoxy-phenyl)-5-methyl-2H-pyrazole-3-carbox...)
Show SMILES COc1ccc(cc1)-n1nc(C)cc1C(=O)Nc1ccc(cn1)-c1ccccc1S(N)(=O)=O
Show InChI InChI=1S/C23H21N5O4S/c1-15-13-20(28(27-15)17-8-10-18(32-2)11-9-17)23(29)26-22-12-7-16(14-25-22)19-5-3-4-6-21(19)33(24,30)31/h3-14H,1-2H3,(H2,24,30,31)(H,25,26,29)
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Article
PubMed
16n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Tested in vitro for inhibition of human Coagulation factor X


J Med Chem 46: 5298-315 (2003)


Article DOI: 10.1021/jm030212h
BindingDB Entry DOI: 10.7270/Q2ZW1MP2
More data for this
Ligand-Target Pair
Trypsin-1


(Homo sapiens (Human))
BDBM50135948
PNG
(2-(4-Methoxy-phenyl)-5-methyl-2H-pyrazole-3-carbox...)
Show SMILES COc1ccc(cc1)-n1nc(C)cc1C(=O)Nc1ccc(cn1)-c1ccccc1S(N)(=O)=O
Show InChI InChI=1S/C23H21N5O4S/c1-15-13-20(28(27-15)17-8-10-18(32-2)11-9-17)23(29)26-22-12-7-16(14-25-22)19-5-3-4-6-21(19)33(24,30)31/h3-14H,1-2H3,(H2,24,30,31)(H,25,26,29)
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Article
PubMed
>1.50E+3n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Tested in vitro for inhibition of human trypsin


J Med Chem 46: 5298-315 (2003)


Article DOI: 10.1021/jm030212h
BindingDB Entry DOI: 10.7270/Q2ZW1MP2
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))
BDBM50135948
PNG
(2-(4-Methoxy-phenyl)-5-methyl-2H-pyrazole-3-carbox...)
Show SMILES COc1ccc(cc1)-n1nc(C)cc1C(=O)Nc1ccc(cn1)-c1ccccc1S(N)(=O)=O
Show InChI InChI=1S/C23H21N5O4S/c1-15-13-20(28(27-15)17-8-10-18(32-2)11-9-17)23(29)26-22-12-7-16(14-25-22)19-5-3-4-6-21(19)33(24,30)31/h3-14H,1-2H3,(H2,24,30,31)(H,25,26,29)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>2.10E+4n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
In vitro for inhibition of human thrombin


J Med Chem 46: 5298-315 (2003)


Article DOI: 10.1021/jm030212h
BindingDB Entry DOI: 10.7270/Q2ZW1MP2
More data for this
Ligand-Target Pair