Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 492.5 BDBM50254938

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

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))	BDBM50254938 ((R)-N-(2-cyclopropyl-5-oxo-1,1',3',5-tetrahydrospi...) Show SMILES O=C(Cn1c2ccccc2n(-c2ccccn2)c1=O)Nc1ccc2C[C@]3(Cc2c1)N=C(NC3=O)C1CC1 |r,c:34| Show InChI InChI=1S/C28H24N6O3/c35-24(16-33-21-5-1-2-6-22(21)34(27(33)37)23-7-3-4-12-29-23)30-20-11-10-18-14-28(15-19(18)13-20)26(36)31-25(32-28)17-8-9-17/h1-7,10-13,17H,8-9,14-16H2,(H,30,35)(H,31,32,36)/t28-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck& Co Curated by ChEMBL					Assay Description Displacement of [125I]hCGRP from human CGRP receptor expressed in HEK293 cells coexpressing RAMP1				Bioorg Med Chem Lett 19: 214-7 (2008) Article DOI: 10.1016/j.bmcl.2008.10.106 BindingDB Entry DOI: 10.7270/Q21C1XSK
					More data for this Ligand-Target Pair