BDBM50144407 CHEMBL308209::Quinoxaline-2-carboxylic acid [(1S,2S,4R)-2-hydroxy-1-(4-hydroxy-benzyl)-6-methyl-4-methylcarbamoyl-heptyl]-amide

SMILES: CNC(=O)[C@H](CC(C)C)C[C@H](O)[C@H](Cc1ccc(O)cc1)NC(=O)c1cnc2ccccc2n1

InChI Key: InChIKey=HFUFFFSLWGHGEP-OUOWLKGYSA-N

Data: 1 IC50

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 = 50144407   

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 chemokine receptor type 1 (Homo sapiens (Human))	BDBM50144407 (CHEMBL308209 | Quinoxaline-2-carboxylic acid [(1S,...) Show SMILES CNC(=O)[C@H](CC(C)C)C[C@H](O)[C@H](Cc1ccc(O)cc1)NC(=O)c1cnc2ccccc2n1 Show InChI InChI=1S/C26H32N4O4/c1-16(2)12-18(25(33)27-3)14-24(32)22(13-17-8-10-19(31)11-9-17)30-26(34)23-15-28-20-6-4-5-7-21(20)29-23/h4-11,15-16,18,22,24,31-32H,12-14H2,1-3H3,(H,27,33)(H,30,34)/t18-,22+,24+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	610	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Inhibition of CCL3 binding to C-C chemokine receptor type 1				Bioorg Med Chem Lett 14: 2169-73 (2004) Article DOI: 10.1016/j.bmcl.2004.02.021 BindingDB Entry DOI: 10.7270/Q2833RGN
					More data for this Ligand-Target Pair