BDBM50135958 2-[2-(3-Amino-propyl)-phenyl]-5-trifluoromethyl-2H-pyrazole-3-carboxylic acid (3-fluoro-2'-methanesulfonyl-biphenyl-4-yl)-amide::CHEMBL343472

SMILES: CS(=O)(=O)c1ccccc1-c1ccc(NC(=O)c2cc(nn2-c2ccccc2CCCN)C(F)(F)F)c(F)c1

InChI Key: InChIKey=ILARVNIFBRWOQW-UHFFFAOYSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50135958   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Coagulation factor X (Homo sapiens (Human))	BDBM50135958 (2-[2-(3-Amino-propyl)-phenyl]-5-trifluoromethyl-2H...) Show SMILES CS(=O)(=O)c1ccccc1-c1ccc(NC(=O)c2cc(nn2-c2ccccc2CCCN)C(F)(F)F)c(F)c1 Show InChI InChI=1S/C27H24F4N4O3S/c1-39(37,38)24-11-5-3-9-19(24)18-12-13-21(20(28)15-18)33-26(36)23-16-25(27(29,30)31)34-35(23)22-10-4-2-7-17(22)8-6-14-32/h2-5,7,9-13,15-16H,6,8,14,32H2,1H3,(H,33,36)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	600	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/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
Prothrombin (Homo sapiens (Human))	BDBM50135958 (2-[2-(3-Amino-propyl)-phenyl]-5-trifluoromethyl-2H...) Show SMILES CS(=O)(=O)c1ccccc1-c1ccc(NC(=O)c2cc(nn2-c2ccccc2CCCN)C(F)(F)F)c(F)c1 Show InChI InChI=1S/C27H24F4N4O3S/c1-39(37,38)24-11-5-3-9-19(24)18-12-13-21(20(28)15-18)33-26(36)23-16-25(27(29,30)31)34-35(23)22-10-4-2-7-17(22)8-6-14-32/h2-5,7,9-13,15-16H,6,8,14,32H2,1H3,(H,33,36)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>2.10E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/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