Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'B2 bradykinin receptor' and Ligand = 'BDBM50093768'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
B2 bradykinin receptor (Homo sapiens (Human))	BDBM50093768 (5-Dibutylamino-pentanoic acid [(S)-1-(4-butyl-pyri...) Show SMILES CCCCN(CCCC)CCCCC(=O)N[C@@H](CC1CCCCC1)c1cc(CCCC)ccn1 Show InChI InChI=1S/C30H53N3O/c1-4-7-15-27-19-20-31-28(24-27)29(25-26-16-11-10-12-17-26)32-30(34)18-13-14-23-33(21-8-5-2)22-9-6-3/h19-20,24,26,29H,4-18,21-23,25H2,1-3H3,(H,32,34)/t29-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	2.30E+4	n/a	n/a	n/a	n/a	n/a
Roche Bioscience Curated by ChEMBL					Assay Description Compound was assayed for binding against the human Bradykinin receptor B2 expressed in CHO cells				Bioorg Med Chem Lett 10: 2421-5 (2001) BindingDB Entry DOI: 10.7270/Q20001BH
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