BDBM196997 US9206164, 61

SMILES: CCc1nn(Cc2ccc(cc2)-c2nc3ccncc3[nH]2)c(CC)c1CC(O)=O

InChI Key: InChIKey=WRCGBJYCRPBFBL-UHFFFAOYSA-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 = 196997   

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))	BDBM196997 (US9206164, 61) Show SMILES CCc1nn(Cc2ccc(cc2)-c2nc3ccncc3[nH]2)c(CC)c1CC(O)=O Show InChI InChI=1S/C22H23N5O2/c1-3-17-16(11-21(28)29)20(4-2)27(26-17)13-14-5-7-15(8-6-14)22-24-18-9-10-23-12-19(18)25-22/h5-10,12H,3-4,11,13H2,1-2H3,(H,24,25)(H,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	56.4	n/a	n/a	n/a	n/a	n/a	n/a	7.4	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...				US Patent US9206164 (2015) BindingDB Entry DOI: 10.7270/Q2PR7TS9
					More data for this Ligand-Target Pair