Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Calcitonin gene-related peptide type 1 receptor' and Ligand = 'BDBM50373781'   

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
Calcitonin gene-related peptide type 1 receptor (Homo sapiens (Human))	BDBM50373781 (CHEMBL257252) Show SMILES Fc1cccc(-c2cc(NC(=O)N3CCC(CC3)n3c4cccnc4[nH]c3=O)c(=O)n(CC(F)(F)F)c2)c1F Show InChI InChI=1S/C25H21F5N6O3/c26-17-4-1-3-16(20(17)27)14-11-18(22(37)35(12-14)13-25(28,29)30)32-23(38)34-9-6-15(7-10-34)36-19-5-2-8-31-21(19)33-24(36)39/h1-5,8,11-12,15H,6-7,9-10,13H2,(H,32,38)(H,31,33,39)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	17	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1				Bioorg Med Chem Lett 18: 755-8 (2008) Article DOI: 10.1016/j.bmcl.2007.11.042 BindingDB Entry DOI: 10.7270/Q2T43TZ2
					More data for this Ligand-Target Pair
Calcitonin gene-related peptide type 1 receptor (Homo sapiens (Human))	BDBM50373781 (CHEMBL257252) Show SMILES Fc1cccc(-c2cc(NC(=O)N3CCC(CC3)n3c4cccnc4[nH]c3=O)c(=O)n(CC(F)(F)F)c2)c1F Show InChI InChI=1S/C25H21F5N6O3/c26-17-4-1-3-16(20(17)27)14-11-18(22(37)35(12-14)13-25(28,29)30)32-23(38)34-9-6-15(7-10-34)36-19-5-2-8-31-21(19)33-24(36)39/h1-5,8,11-12,15H,6-7,9-10,13H2,(H,32,38)(H,31,33,39)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay				Bioorg Med Chem Lett 18: 755-8 (2008) Article DOI: 10.1016/j.bmcl.2007.11.042 BindingDB Entry DOI: 10.7270/Q2T43TZ2
					More data for this Ligand-Target Pair
Calcitonin gene-related peptide type 1 receptor (Homo sapiens (Human))	BDBM50373781 (CHEMBL257252) Show SMILES Fc1cccc(-c2cc(NC(=O)N3CCC(CC3)n3c4cccnc4[nH]c3=O)c(=O)n(CC(F)(F)F)c2)c1F Show InChI InChI=1S/C25H21F5N6O3/c26-17-4-1-3-16(20(17)27)14-11-18(22(37)35(12-14)13-25(28,29)30)32-23(38)34-9-6-15(7-10-34)36-19-5-2-8-31-21(19)33-24(36)39/h1-5,8,11-12,15H,6-7,9-10,13H2,(H,32,38)(H,31,33,39)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	811	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation in presence of 50% human serum by cell based ...				Bioorg Med Chem Lett 18: 755-8 (2008) Article DOI: 10.1016/j.bmcl.2007.11.042 BindingDB Entry DOI: 10.7270/Q2T43TZ2
					More data for this Ligand-Target Pair