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 = 'BDBM50302876'   

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))	BDBM50302876 (CHEMBL577957 | N-((3R,6S)-6-(2,3-difluorophenyl)-2...) Show SMILES Fc1cccc([C@@H]2CC[C@@H](NC(=O)N3CCC4(CC3)NC(=O)NC4=O)C(=O)N(CC(F)(F)F)C2)c1F |r| Show InChI InChI=1S/C22H24F5N5O4/c23-14-3-1-2-13(16(14)24)12-4-5-15(17(33)32(10-12)11-22(25,26)27)28-20(36)31-8-6-21(7-9-31)18(34)29-19(35)30-21/h1-3,12,15H,4-11H2,(H,28,36)(H2,29,30,34,35)/t12-,15-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	46	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]human CGRP from human CLR expressed in HEK 293 cells coexpressing human RAMP1 after 3 hrs by scintillation counting				Bioorg Med Chem Lett 19: 6368-72 (2009) Article DOI: 10.1016/j.bmcl.2009.09.066 BindingDB Entry DOI: 10.7270/Q2PC32FD
					More data for this Ligand-Target Pair
Calcitonin gene-related peptide type 1 receptor (Homo sapiens (Human))	BDBM50302876 (CHEMBL577957 | N-((3R,6S)-6-(2,3-difluorophenyl)-2...) Show SMILES Fc1cccc([C@@H]2CC[C@@H](NC(=O)N3CCC4(CC3)NC(=O)NC4=O)C(=O)N(CC(F)(F)F)C2)c1F |r| Show InChI InChI=1S/C22H24F5N5O4/c23-14-3-1-2-13(16(14)24)12-4-5-15(17(33)32(10-12)11-22(25,26)27)28-20(36)31-8-6-21(7-9-31)18(34)29-19(35)30-21/h1-3,12,15H,4-11H2,(H,28,36)(H2,29,30,34,35)/t12-,15-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	94	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Antagonist activity at human CLR expressed in HEK293 cells coexpressing human RAMP1 assessed as inhibition of human CGRPalpha-induced cAMP production...				Bioorg Med Chem Lett 19: 6368-72 (2009) Article DOI: 10.1016/j.bmcl.2009.09.066 BindingDB Entry DOI: 10.7270/Q2PC32FD
					More data for this Ligand-Target Pair
Calcitonin gene-related peptide type 1 receptor (Homo sapiens (Human))	BDBM50302876 (CHEMBL577957 | N-((3R,6S)-6-(2,3-difluorophenyl)-2...) Show SMILES Fc1cccc([C@@H]2CC[C@@H](NC(=O)N3CCC4(CC3)NC(=O)NC4=O)C(=O)N(CC(F)(F)F)C2)c1F |r| Show InChI InChI=1S/C22H24F5N5O4/c23-14-3-1-2-13(16(14)24)12-4-5-15(17(33)32(10-12)11-22(25,26)27)28-20(36)31-8-6-21(7-9-31)18(34)29-19(35)30-21/h1-3,12,15H,4-11H2,(H,28,36)(H2,29,30,34,35)/t12-,15-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	122	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Antagonist activity at human CLR expressed in HEK293 cells coexpressing human RAMP1 assessed as inhibition of human CGRPalpha-induced cAMP production...				Bioorg Med Chem Lett 19: 6368-72 (2009) Article DOI: 10.1016/j.bmcl.2009.09.066 BindingDB Entry DOI: 10.7270/Q2PC32FD
					More data for this Ligand-Target Pair