BDBM50067923 3-(6-Acetylamino-pyridin-3-yl)-N-{1-[2,4-bis-acetylamino-3-(2-methyl-quinolin-8-yloxymethyl)-phenyl]-1H-pyrrol-2-ylmethyl}-acrylamide::CHEMBL555976

SMILES: CC(=O)Nc1ccc(\C=C\C(=O)NCc2cccn2-c2ccc(NC(C)=O)c(COc3cccc4ccc(C)nc34)c2NC(C)=O)cn1

InChI Key: InChIKey=MYROTHAHAMWEBP-SFQUDFHCSA-N

Data: 2 IC50

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 = 50067923   

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))	BDBM50067923 (3-(6-Acetylamino-pyridin-3-yl)-N-{1-[2,4-bis-acety...) Show SMILES CC(=O)Nc1ccc(\C=C\C(=O)NCc2cccn2-c2ccc(NC(C)=O)c(COc3cccc4ccc(C)nc34)c2NC(C)=O)cn1 Show InChI InChI=1S/C36H35N7O5/c1-22-10-13-27-7-5-9-32(35(27)39-22)48-21-29-30(40-23(2)44)14-15-31(36(29)42-25(4)46)43-18-6-8-28(43)20-38-34(47)17-12-26-11-16-33(37-19-26)41-24(3)45/h5-19H,20-21H2,1-4H3,(H,38,47)(H,40,44)(H,42,46)(H,37,41,45)/b17-12+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.370	n/a	n/a	n/a	n/a	n/a	n/a
Fujisawa Pharmaceutical Ltd. Curated by ChEMBL					Assay Description Inhibition of the specific binding of [3H]BK to Bradykinin receptor B2 in guinea pig ileum membrane preparations				J Med Chem 41: 4587-98 (1998) Article DOI: 10.1021/jm980330i BindingDB Entry DOI: 10.7270/Q2ZK5HBR
					More data for this Ligand-Target Pair
Bradykinin B2 receptor (Cavia porcellus)	BDBM50067923 (3-(6-Acetylamino-pyridin-3-yl)-N-{1-[2,4-bis-acety...) Show SMILES CC(=O)Nc1ccc(\C=C\C(=O)NCc2cccn2-c2ccc(NC(C)=O)c(COc3cccc4ccc(C)nc34)c2NC(C)=O)cn1 Show InChI InChI=1S/C36H35N7O5/c1-22-10-13-27-7-5-9-32(35(27)39-22)48-21-29-30(40-23(2)44)14-15-31(36(29)42-25(4)46)43-18-6-8-28(43)20-38-34(47)17-12-26-11-16-33(37-19-26)41-24(3)45/h5-19H,20-21H2,1-4H3,(H,38,47)(H,40,44)(H,42,46)(H,37,41,45)/b17-12+	MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.560	n/a	n/a	n/a	n/a	n/a	n/a
Fujisawa Pharmaceutical Ltd. Curated by ChEMBL					Assay Description Inhibition of the specific binding of [3H]BK to Bradykinin receptor B2 in guinea pig ileum membrane preparations				J Med Chem 41: 4587-98 (1998) Article DOI: 10.1021/jm980330i BindingDB Entry DOI: 10.7270/Q2ZK5HBR
					More data for this Ligand-Target Pair