Compile Data Set for Download or QSAR

Found 5 hits Enz. Inhib. hit(s) with Target = 'Free fatty acid receptor 1' and Ligand = 'BDBM50344071'   

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
Free fatty acid receptor 1 (Homo sapiens (Human))	BDBM50344071 (CHEMBL1777864 | rac-3-(4-(4-cyanonaphthalen-1-ylox...) Show SMILES CC#CC(CC(O)=O)c1ccc(Oc2ccc(C#N)c3ccccc23)cc1 Show InChI InChI=1S/C23H17NO3/c1-2-5-17(14-23(25)26)16-8-11-19(12-9-16)27-22-13-10-18(15-24)20-6-3-4-7-21(20)22/h3-4,6-13,17H,14H2,1H3,(H,25,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of human GPR40 expressed in CHO cells by SPA based binding assay				Bioorg Med Chem Lett 21: 3390-4 (2011) Article DOI: 10.1016/j.bmcl.2011.03.114 BindingDB Entry DOI: 10.7270/Q2KP82GX
					More data for this Ligand-Target Pair
Free fatty acid receptor 1 (Homo sapiens (Human))	BDBM50344071 (CHEMBL1777864 | rac-3-(4-(4-cyanonaphthalen-1-ylox...) Show SMILES CC#CC(CC(O)=O)c1ccc(Oc2ccc(C#N)c3ccccc23)cc1 Show InChI InChI=1S/C23H17NO3/c1-2-5-17(14-23(25)26)16-8-11-19(12-9-16)27-22-13-10-18(15-24)20-6-3-4-7-21(20)22/h3-4,6-13,17H,14H2,1H3,(H,25,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	53	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Agonist activity at human GPR40 expressed in CHO cells assessed as intracellular calcium mobilization by FLIPR assay				Bioorg Med Chem Lett 21: 3390-4 (2011) Article DOI: 10.1016/j.bmcl.2011.03.114 BindingDB Entry DOI: 10.7270/Q2KP82GX
					More data for this Ligand-Target Pair
Free fatty acid receptor 1 (Mus musculus)	BDBM50344071 (CHEMBL1777864 | rac-3-(4-(4-cyanonaphthalen-1-ylox...) Show SMILES CC#CC(CC(O)=O)c1ccc(Oc2ccc(C#N)c3ccccc23)cc1 Show InChI InChI=1S/C23H17NO3/c1-2-5-17(14-23(25)26)16-8-11-19(12-9-16)27-22-13-10-18(15-24)20-6-3-4-7-21(20)22/h3-4,6-13,17H,14H2,1H3,(H,25,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	93	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Agonist activity at mouse GPR40 expressed in CHO cells assessed as intracellular calcium mobilization by FLIPR assay				Bioorg Med Chem Lett 21: 3390-4 (2011) Article DOI: 10.1016/j.bmcl.2011.03.114 BindingDB Entry DOI: 10.7270/Q2KP82GX
					More data for this Ligand-Target Pair
Free fatty acid receptor 1 (Homo sapiens (Human))	BDBM50344071 (CHEMBL1777864 | rac-3-(4-(4-cyanonaphthalen-1-ylox...) Show SMILES CC#CC(CC(O)=O)c1ccc(Oc2ccc(C#N)c3ccccc23)cc1 Show InChI InChI=1S/C23H17NO3/c1-2-5-17(14-23(25)26)16-8-11-19(12-9-16)27-22-13-10-18(15-24)20-6-3-4-7-21(20)22/h3-4,6-13,17H,14H2,1H3,(H,25,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	247	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Agonist activity at human GPR40 expressed in HEK293 cells assessed as [3H]IP3 production in presence of 0.4% serum albumin				Bioorg Med Chem Lett 21: 3390-4 (2011) Article DOI: 10.1016/j.bmcl.2011.03.114 BindingDB Entry DOI: 10.7270/Q2KP82GX
					More data for this Ligand-Target Pair
Free fatty acid receptor 1 (Homo sapiens (Human))	BDBM50344071 (CHEMBL1777864 | rac-3-(4-(4-cyanonaphthalen-1-ylox...) Show SMILES CC#CC(CC(O)=O)c1ccc(Oc2ccc(C#N)c3ccccc23)cc1 Show InChI InChI=1S/C23H17NO3/c1-2-5-17(14-23(25)26)16-8-11-19(12-9-16)27-22-13-10-18(15-24)20-6-3-4-7-21(20)22/h3-4,6-13,17H,14H2,1H3,(H,25,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	172	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Agonist activity at human GPR40 expressed in HEK293 cells assessed as [3H]IP3 production in presence of 10% human serum				Bioorg Med Chem Lett 21: 3390-4 (2011) Article DOI: 10.1016/j.bmcl.2011.03.114 BindingDB Entry DOI: 10.7270/Q2KP82GX
					More data for this Ligand-Target Pair