BDBM50260329 CHEMBL4098400

SMILES: Cc1cc(nc(C)n1)N(Cc1ccc(cc1)-n1cc(CCN2CCC(O)CC2)nn1)CC(C)(C)C

InChI Key: InChIKey=UWIAVYPOSIEYKP-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50260329   

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 4 (Rattus norvegicus)	BDBM50260329 (CHEMBL4098400) Show SMILES Cc1cc(nc(C)n1)N(Cc1ccc(cc1)-n1cc(CCN2CCC(O)CC2)nn1)CC(C)(C)C Show InChI InChI=1S/C27H39N7O/c1-20-16-26(29-21(2)28-20)33(19-27(3,4)5)17-22-6-8-24(9-7-22)34-18-23(30-31-34)10-13-32-14-11-25(35)12-15-32/h6-9,16,18,25,35H,10-15,17,19H2,1-5H3	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	480	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Antagonist activity at rat GPR4 expressed in HEK cells assessed as inhibition of pH-induced cAMP accumulation preincubated for 15 mins followed by cA...				Bioorg Med Chem 25: 4512-4525 (2017) Article DOI: 10.1016/j.bmc.2017.06.050 BindingDB Entry DOI: 10.7270/Q2NS0XB3
					More data for this Ligand-Target Pair
G-protein coupled receptor 4 (GPR4) (Homo sapiens (Human))	BDBM50260329 (CHEMBL4098400) Show SMILES Cc1cc(nc(C)n1)N(Cc1ccc(cc1)-n1cc(CCN2CCC(O)CC2)nn1)CC(C)(C)C Show InChI InChI=1S/C27H39N7O/c1-20-16-26(29-21(2)28-20)33(19-27(3,4)5)17-22-6-8-24(9-7-22)34-18-23(30-31-34)10-13-32-14-11-25(35)12-15-32/h6-9,16,18,25,35H,10-15,17,19H2,1-5H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Antagonist activity at human GPR4 expressed in African green monkey COS7 cells assessed as inhibition of pH 6.5-induced cAMP accumulation after 30 mi...				Bioorg Med Chem 25: 4512-4525 (2017) Article DOI: 10.1016/j.bmc.2017.06.050 BindingDB Entry DOI: 10.7270/Q2NS0XB3
					More data for this Ligand-Target Pair
G-protein coupled receptor 4 (Mus musculus)	BDBM50260329 (CHEMBL4098400) Show SMILES Cc1cc(nc(C)n1)N(Cc1ccc(cc1)-n1cc(CCN2CCC(O)CC2)nn1)CC(C)(C)C Show InChI InChI=1S/C27H39N7O/c1-20-16-26(29-21(2)28-20)33(19-27(3,4)5)17-22-6-8-24(9-7-22)34-18-23(30-31-34)10-13-32-14-11-25(35)12-15-32/h6-9,16,18,25,35H,10-15,17,19H2,1-5H3	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Antagonist activity at mouse GPR4 expressed in HEK cells assessed as inhibition of pH-induced cAMP accumulation preincubated for 15 mins followed by ...				Bioorg Med Chem 25: 4512-4525 (2017) Article DOI: 10.1016/j.bmc.2017.06.050 BindingDB Entry DOI: 10.7270/Q2NS0XB3
					More data for this Ligand-Target Pair