Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Calcitonin gene-related peptide type 1 receptor' and Ligand = 'BDBM50302889'   

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))	BDBM50302889 (CHEMBL585017 | N-((3R,6S)-6-(2,3-difluorophenyl)-2...) Show SMILES CN1C(=O)NC(=O)C11CCN(CC1)C(=O)N[C@@H]1CC[C@H](CN(CC(F)(F)F)C1=O)c1cccc(F)c1F |r| Show InChI InChI=1S/C23H26F5N5O4/c1-31-20(36)30-19(35)22(31)7-9-32(10-8-22)21(37)29-16-6-5-13(14-3-2-4-15(24)17(14)25)11-33(18(16)34)12-23(26,27)28/h2-4,13,16H,5-12H2,1H3,(H,29,37)(H,30,35,36)/t13-,16-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	510	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
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