BDBM50381275 CHEMBL2018865

SMILES: Clc1ccc(cc1Cl)S(=O)(=O)N1CCc2ccccc2C1CC(=O)N1CCC(Cc2ccc(cc2)C2=NCCN2)CC1

InChI Key: InChIKey=LJVFUNKIIQVDNX-UHFFFAOYSA-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 = 50381275   

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))	BDBM50381275 (CHEMBL2018865) Show SMILES Clc1ccc(cc1Cl)S(=O)(=O)N1CCc2ccccc2C1CC(=O)N1CCC(Cc2ccc(cc2)C2=NCCN2)CC1 |t:39| Show InChI InChI=1S/C32H34Cl2N4O3S/c33-28-10-9-26(20-29(28)34)42(40,41)38-18-13-24-3-1-2-4-27(24)30(38)21-31(39)37-16-11-23(12-17-37)19-22-5-7-25(8-6-22)32-35-14-15-36-32/h1-10,20,23,30H,11-19,21H2,(H,35,36)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Gedeon Richter Plc. Curated by ChEMBL					Assay Description Binding affinity to human bradykinin B1 receptor				Bioorg Med Chem Lett 22: 3095-9 (2012) Article DOI: 10.1016/j.bmcl.2012.03.065 BindingDB Entry DOI: 10.7270/Q21Z45F0
					More data for this Ligand-Target Pair