BDBM50182457 CHEMBL202463::methyl 4'-[({[(3,3,3-trifluoropropanoyl)amino]acetyl}amino)methyl]-1,1'-biphenyl-2-carboxylate

SMILES: COC(=O)c1ccccc1-c1ccc(CNC(=O)CNC(=O)CC(F)(F)F)cc1

InChI Key: InChIKey=SIJCBADTDAULTA-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 = 50182457   

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
BDKRB2 (Homo sapiens (Human))	BDBM50182457 (CHEMBL202463 | methyl 4'-[({[(3,3,3-trifluoropropa...) Show SMILES COC(=O)c1ccccc1-c1ccc(CNC(=O)CNC(=O)CC(F)(F)F)cc1 Show InChI InChI=1S/C20H19F3N2O4/c1-29-19(28)16-5-3-2-4-15(16)14-8-6-13(7-9-14)11-24-18(27)12-25-17(26)10-20(21,22)23/h2-9H,10-12H2,1H3,(H,24,27)(H,25,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity to bradykinin B2 receptor				J Med Chem 49: 1231-4 (2006) Article DOI: 10.1021/jm0511280 BindingDB Entry DOI: 10.7270/Q2MW2GQ4
					More data for this Ligand-Target Pair
Bradykinin B1 receptor (Homo sapiens (Human))	BDBM50182457 (CHEMBL202463 | methyl 4'-[({[(3,3,3-trifluoropropa...) Show SMILES COC(=O)c1ccccc1-c1ccc(CNC(=O)CNC(=O)CC(F)(F)F)cc1 Show InChI InChI=1S/C20H19F3N2O4/c1-29-19(28)16-5-3-2-4-15(16)14-8-6-13(7-9-14)11-24-18(27)12-25-17(26)10-20(21,22)23/h2-9H,10-12H2,1H3,(H,24,27)(H,25,26)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.20E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity to human bradykinin B1 receptor expressed in CHO cells				J Med Chem 49: 1231-4 (2006) Article DOI: 10.1021/jm0511280 BindingDB Entry DOI: 10.7270/Q2MW2GQ4
					More data for this Ligand-Target Pair