BDBM50440544 CHEMBL2426344

SMILES: CC(C)[C@@]1(CC[C@H](C1)NCCCc1ccccc1)C(=O)NCc1cc(cc(c1)C(F)(F)F)C(F)(F)F

InChI Key: InChIKey=BAWPCIRDHSZWMX-NOZRDPDXSA-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 = 50440544   

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
C-C motif chemokine 2 (Homo sapiens (Human))	BDBM50440544 (CHEMBL2426344) Show SMILES CC(C)[C@@]1(CC[C@H](C1)NCCCc1ccccc1)C(=O)NCc1cc(cc(c1)C(F)(F)F)C(F)(F)F |r| Show InChI InChI=1S/C27H32F6N2O/c1-18(2)25(11-10-23(16-25)34-12-6-9-19-7-4-3-5-8-19)24(36)35-17-20-13-21(26(28,29)30)15-22(14-20)27(31,32)33/h3-5,7-8,13-15,18,23,34H,6,9-12,16-17H2,1-2H3,(H,35,36)/t23-,25+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	134	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Leiden University Curated by ChEMBL					Assay Description Displacement of [125I]-CCL2 from human CCR2 receptor expressed in human U2OS cell membranes				J Med Chem 56: 7706-14 (2013) Article DOI: 10.1021/jm4011737 BindingDB Entry DOI: 10.7270/Q2FT8NG3
					More data for this Ligand-Target Pair