BDBM50202427 CHEMBL221288::methyl 4'-[(1R)-1-({[1-(acetylamino)cyclopropyl]carbonyl}-amino)ethyl]-3,3'-difluoro-1,1'-biphenyl-2-carboxylate

SMILES: COC(=O)c1c(F)cccc1-c1ccc([C@@H](C)NC(=O)C2(CC2)NC(C)=O)c(F)c1

InChI Key: InChIKey=QXADEGGJHUEGCT-GFCCVEGCSA-N

Data: 1 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 1 hit for monomerid = 50202427   

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
Bradykinin B1 receptor (Homo sapiens (Human))	BDBM50202427 (CHEMBL221288 | methyl 4'-[(1R)-1-({[1-(acetylamino...) Show SMILES COC(=O)c1c(F)cccc1-c1ccc([C@@H](C)NC(=O)C2(CC2)NC(C)=O)c(F)c1 |r| Show InChI InChI=1S/C22H22F2N2O4/c1-12(25-21(29)22(9-10-22)26-13(2)27)15-8-7-14(11-18(15)24)16-5-4-6-17(23)19(16)20(28)30-3/h4-8,11-12H,9-10H2,1-3H3,(H,25,29)(H,26,27)/t12-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.930	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Displacement of [3H]des-Arg10 Leu9 kallidin from human bradykinin B1 receptor expressed in CHO cells				J Med Chem 50: 272-82 (2007) Article DOI: 10.1021/jm061094b BindingDB Entry DOI: 10.7270/Q2X63MMQ
					More data for this Ligand-Target Pair