BDBM50405698 CHEMBL4159670

SMILES: CN1C(Nc2ccccc2C1=O)c1cc(C)c2oc(=O)c(cc2c1)-c1ccc2OCOc2c1

InChI Key: InChIKey=HWMBMUPESDGTNC-CZGNIMDHSA-N

Data: 2 EC50

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 2 hits for monomerid = 50405698   

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
Hydroxycarboxylic acid receptor 2 (Homo sapiens (Human))	BDBM50405698 (CHEMBL4159670) Show SMILES CN1C(Nc2ccccc2C1=O)c1cc(C)c2oc(=O)c(cc2c1)-c1ccc2OCOc2c1 Show InChI InChI=1S/C24H28N2O5S/c1-16(25-20(23(28)29)13-12-17-8-4-2-5-9-17)22(27)26-15-19(14-21(26)24(30)31)32-18-10-6-3-7-11-18/h2-11,16,19-21,25H,12-15H2,1H3,(H,28,29)(H,30,31)/t16-,19+,20-,21-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	454	n/a	n/a	n/a	n/a
CSIR-Central Drug Research Institute Curated by ChEMBL					Assay Description Agonist activity at human GPR109a expressed in HTLA cells assessed as increase in beta-arrestin2 recruitment after overnight incubation by Tango assa...				Eur J Med Chem 152: 208-222 (2018) Article DOI: 10.1016/j.ejmech.2018.04.037 BindingDB Entry DOI: 10.7270/Q2B27XT0
					More data for this Ligand-Target Pair
Hydroxycarboxylic acid receptor 2 (Homo sapiens (Human))	BDBM50405698 (CHEMBL4159670) Show SMILES CN1C(Nc2ccccc2C1=O)c1cc(C)c2oc(=O)c(cc2c1)-c1ccc2OCOc2c1 Show InChI InChI=1S/C24H28N2O5S/c1-16(25-20(23(28)29)13-12-17-8-4-2-5-9-17)22(27)26-15-19(14-21(26)24(30)31)32-18-10-6-3-7-11-18/h2-11,16,19-21,25H,12-15H2,1H3,(H,28,29)(H,30,31)/t16-,19+,20-,21-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	457	n/a	n/a	n/a	n/a
CSIR-Central Drug Research Institute Curated by ChEMBL					Assay Description Agonist activity at human GPR109a expressed in HTLA cells assessed as increase in beta-arrestin2 recruitment after overnight incubation by Tango assa...				Eur J Med Chem 152: 208-222 (2018) Article DOI: 10.1016/j.ejmech.2018.04.037 BindingDB Entry DOI: 10.7270/Q2B27XT0
					More data for this Ligand-Target Pair