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 = 'BDBM50302882'   

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))	BDBM50302882 (CHEMBL570531 | N-((3R,6S)-6-(2,3-difluorophenyl)-2...) Show SMILES Fc1cccc([C@@H]2CC[C@@H](NC(=O)N3CCC4(CC3)CC(=O)Nc3ncccc43)C(=O)N(CC(F)(F)F)C2)c1F |r| Show InChI InChI=1S/C27H28F5N5O3/c28-19-5-1-3-17(22(19)29)16-6-7-20(24(39)37(14-16)15-27(30,31)32)34-25(40)36-11-8-26(9-12-36)13-21(38)35-23-18(26)4-2-10-33-23/h1-5,10,16,20H,6-9,11-15H2,(H,34,40)(H,33,35,38)/t16-,20-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	3.5	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))	BDBM50302882 (CHEMBL570531 | N-((3R,6S)-6-(2,3-difluorophenyl)-2...) Show SMILES Fc1cccc([C@@H]2CC[C@@H](NC(=O)N3CCC4(CC3)CC(=O)Nc3ncccc43)C(=O)N(CC(F)(F)F)C2)c1F |r| Show InChI InChI=1S/C27H28F5N5O3/c28-19-5-1-3-17(22(19)29)16-6-7-20(24(39)37(14-16)15-27(30,31)32)34-25(40)36-11-8-26(9-12-36)13-21(38)35-23-18(26)4-2-10-33-23/h1-5,10,16,20H,6-9,11-15H2,(H,34,40)(H,33,35,38)/t16-,20-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	11	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))	BDBM50302882 (CHEMBL570531 | N-((3R,6S)-6-(2,3-difluorophenyl)-2...) Show SMILES Fc1cccc([C@@H]2CC[C@@H](NC(=O)N3CCC4(CC3)CC(=O)Nc3ncccc43)C(=O)N(CC(F)(F)F)C2)c1F |r| Show InChI InChI=1S/C27H28F5N5O3/c28-19-5-1-3-17(22(19)29)16-6-7-20(24(39)37(14-16)15-27(30,31)32)34-25(40)36-11-8-26(9-12-36)13-21(38)35-23-18(26)4-2-10-33-23/h1-5,10,16,20H,6-9,11-15H2,(H,34,40)(H,33,35,38)/t16-,20-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	11	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