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 = 'BDBM103495'   

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))	BDBM103495 (US8552023, 7) Show SMILES C[C@@H](N(C\C=C\c1cnc2C[C@]3(Cc2c1)C(=O)Nc1ncccc31)C(=O)C(C)(C)CF)c1cc(F)cc(F)c1 |r| Show InChI InChI=1S/C30H29F3N4O2/c1-18(20-11-22(32)13-23(33)12-20)37(28(39)29(2,3)17-31)9-5-6-19-10-21-14-30(15-25(21)35-16-19)24-7-4-8-34-26(24)36-27(30)38/h4-8,10-13,16,18H,9,14-15,17H2,1-3H3,(H,34,36,38)/b6-5+/t18-,30+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	0.0410	n/a	n/a	n/a	n/a	n/a	n/a	7.4	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Inhibition of the binding of 125I-CGRP to receptors and functional antagonism of CGRP receptors were determined using native receptor binding assay.				US Patent US8552023 (2013) BindingDB Entry DOI: 10.7270/Q2VX0F4V
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