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 = 'BDBM50296790'   

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))	BDBM50296790 (CHEMBL549503 | N-((S)-2'-oxo-1,1',2',3-tetrahydros...) Show SMILES O=C(CN1CC2CCC(=O)Nc3cccc1c23)Nc1ccc2C[C@@]3(Cc2c1)C(=O)Nc1ncccc31 |r| Show InChI InChI=1S/C28H25N5O3/c34-23-9-7-17-14-33(22-5-1-4-21(31-23)25(17)22)15-24(35)30-19-8-6-16-12-28(13-18(16)11-19)20-3-2-10-29-26(20)32-27(28)36/h1-6,8,10-11,17H,7,9,12-15H2,(H,30,35)(H,31,34)(H,29,32,36)/t17?,28-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.10	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 HEK293 cells coexpressing human RAMP1				Bioorg Med Chem Lett 19: 4740-2 (2009) Article DOI: 10.1016/j.bmcl.2009.06.057 BindingDB Entry DOI: 10.7270/Q2QV3MJH
					More data for this Ligand-Target Pair
Calcitonin gene-related peptide type 1 receptor (Homo sapiens (Human))	BDBM50296790 (CHEMBL549503 | N-((S)-2'-oxo-1,1',2',3-tetrahydros...) Show SMILES O=C(CN1CC2CCC(=O)Nc3cccc1c23)Nc1ccc2C[C@@]3(Cc2c1)C(=O)Nc1ncccc31 |r| Show InChI InChI=1S/C28H25N5O3/c34-23-9-7-17-14-33(22-5-1-4-21(31-23)25(17)22)15-24(35)30-19-8-6-16-12-28(13-18(16)11-19)20-3-2-10-29-26(20)32-27(28)36/h1-6,8,10-11,17H,7,9,12-15H2,(H,30,35)(H,31,34)(H,29,32,36)/t17?,28-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3	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: 4740-2 (2009) Article DOI: 10.1016/j.bmcl.2009.06.057 BindingDB Entry DOI: 10.7270/Q2QV3MJH
					More data for this Ligand-Target Pair
Calcitonin gene-related peptide type 1 receptor (Homo sapiens (Human))	BDBM50296790 (CHEMBL549503 | N-((S)-2'-oxo-1,1',2',3-tetrahydros...) Show SMILES O=C(CN1CC2CCC(=O)Nc3cccc1c23)Nc1ccc2C[C@@]3(Cc2c1)C(=O)Nc1ncccc31 |r| Show InChI InChI=1S/C28H25N5O3/c34-23-9-7-17-14-33(22-5-1-4-21(31-23)25(17)22)15-24(35)30-19-8-6-16-12-28(13-18(16)11-19)20-3-2-10-29-26(20)32-27(28)36/h1-6,8,10-11,17H,7,9,12-15H2,(H,30,35)(H,31,34)(H,29,32,36)/t17?,28-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	23	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: 4740-2 (2009) Article DOI: 10.1016/j.bmcl.2009.06.057 BindingDB Entry DOI: 10.7270/Q2QV3MJH
					More data for this Ligand-Target Pair