BDBM50440559 CHEMBL2426337

SMILES: CC(C)[C@@]1(CC[C@H](C1)NC1CCCc2c(O)cccc12)C(=O)NCc1cc(cc(c1)C(F)(F)F)C(F)(F)F

InChI Key: InChIKey=LWEWQRGMLFNAIT-MBPASQAPSA-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 = 50440559   

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))	BDBM50440559 (CHEMBL2426337) Show SMILES CC(C)[C@@]1(CC[C@H](C1)NC1CCCc2c(O)cccc12)C(=O)NCc1cc(cc(c1)C(F)(F)F)C(F)(F)F |r| Show InChI InChI=1S/C28H32F6N2O2/c1-16(2)26(10-9-20(14-26)36-23-7-3-6-22-21(23)5-4-8-24(22)37)25(38)35-15-17-11-18(27(29,30)31)13-19(12-17)28(32,33)34/h4-5,8,11-13,16,20,23,36-37H,3,6-7,9-10,14-15H2,1-2H3,(H,35,38)/t20-,23?,26+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	35	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