Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Prostaglandin D2 receptor 2' and Ligand = 'BDBM50401122'   

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
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401122 (CHEMBL2205146) Show SMILES Cc1c(Cc2ccc(=O)n(Cc3ccccc3)n2)c2cc(F)ccc2n1CC(O)=O Show InChI InChI=1S/C23H20FN3O3/c1-15-19(20-11-17(24)7-9-21(20)26(15)14-23(29)30)12-18-8-10-22(28)27(25-18)13-16-5-3-2-4-6-16/h2-11H,12-14H2,1H3,(H,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401122 (CHEMBL2205146) Show SMILES Cc1c(Cc2ccc(=O)n(Cc3ccccc3)n2)c2cc(F)ccc2n1CC(O)=O Show InChI InChI=1S/C23H20FN3O3/c1-15-19(20-11-17(24)7-9-21(20)26(15)14-23(29)30)12-18-8-10-22(28)27(25-18)13-16-5-3-2-4-6-16/h2-11H,12-14H2,1H3,(H,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Antagonist activity at human recombinant CRTh2 expressed in CHO-K1 cells by cAMP TR FRET assay				J Med Chem 57: 1299-322 (2014) Article DOI: 10.1021/jm401509e BindingDB Entry DOI: 10.7270/Q21V5GGH
					More data for this Ligand-Target Pair