Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'C-C chemokine receptor type 1' and Ligand = 'BDBM102313'   

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
C-C chemokine receptor type 1 (Homo sapiens (Human))	BDBM102313 (US8536198, 2) Show SMILES CC1(C)CN(CC[C@]1(O)c1ccc(Cl)cc1)C(=O)[C@H]1CCCC[C@H]1NC(=O)c1ccccc1 |r| Show InChI InChI=1S/C27H33ClN2O3/c1-26(2)18-30(17-16-27(26,33)20-12-14-21(28)15-13-20)25(32)22-10-6-7-11-23(22)29-24(31)19-8-4-3-5-9-19/h3-5,8-9,12-15,22-23,33H,6-7,10-11,16-18H2,1-2H3,(H,29,31)/t22-,23+,27-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	2.10	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description CCR1 ligand binding using scintillation proximity assay (SPA).				US Patent US8536198 (2013) BindingDB Entry DOI: 10.7270/Q2HT2MZ9
					More data for this Ligand-Target Pair