BDBM50188312 2-(3-(7-chloroquinolin-4-yl)-2,6-dimethyl-1H-indol-1-yl)acetic acid::CHEMBL378094

SMILES: Cc1c(-c2ccnc3cc(Cl)ccc23)c2ccc(C)cc2n1CC(O)=O

InChI Key: InChIKey=BBXFOTRWNRLFBT-UHFFFAOYSA-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 = 50188312   

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
G protein-coupled receptor 44 (Homo sapiens (Human))	BDBM50188312 (2-(3-(7-chloroquinolin-4-yl)-2,6-dimethyl-1H-indol...) Show SMILES Cc1c(-c2ccnc3cc(Cl)ccc23)c2ccc(C)cc2n1CC(O)=O |(27.14,-1.36,;25.6,-1.36,;24.69,-2.63,;25.18,-4.09,;26.68,-4.39,;27.17,-5.85,;26.14,-7.01,;24.63,-6.69,;23.62,-7.83,;22.13,-7.53,;21.11,-8.69,;21.64,-6.07,;22.66,-4.93,;24.15,-5.24,;23.21,-2.16,;21.88,-2.92,;20.54,-2.15,;20.54,-.61,;19.21,.16,;21.87,.16,;23.21,-.6,;24.68,-.12,;25.16,1.35,;26.66,1.67,;27.7,.54,;27.14,3.15,)| Show InChI InChI=1S/C21H17ClN2O2/c1-12-3-5-17-19(9-12)24(11-20(25)26)13(2)21(17)16-7-8-23-18-10-14(22)4-6-15(16)18/h3-10H,11H2,1-2H3,(H,25,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	125	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca R&D Charnwood Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from human CRTh2 expressed in HEK293 cells				Bioorg Med Chem Lett 16: 4287-90 (2006) Article DOI: 10.1016/j.bmcl.2006.05.062 BindingDB Entry DOI: 10.7270/Q2G44PX7
					More data for this Ligand-Target Pair