Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 625.6 BDBM50150396

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 1 (Homo sapiens (Human))	BDBM50150396 (CHEMBL3769439) Show SMILES Cc1cc(C[C@@H](NC(=O)N2CCC(CC2)c2ccc(Cl)cc2Cl)C(=O)N2CCC(CC2)N2CCCCC2)cc2cn[nH]c12 |r| Show InChI InChI=1S/C33H42Cl2N6O2/c1-22-17-23(18-25-21-36-38-31(22)25)19-30(32(42)40-15-9-27(10-16-40)39-11-3-2-4-12-39)37-33(43)41-13-7-24(8-14-41)28-6-5-26(34)20-29(28)35/h5-6,17-18,20-21,24,27,30H,2-4,7-16,19H2,1H3,(H,36,38)(H,37,43)/t30-/m1/s1	PDB Reactome pathway UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Discovery Curated by ChEMBL					Assay Description Displacement of [125I]CGRP from alpha CGRP in human SK-N-MC cells after 2 hrs by scintillation counter				Bioorg Med Chem Lett 26: 1229-32 (2016) Article DOI: 10.1016/j.bmcl.2016.01.026 BindingDB Entry DOI: 10.7270/Q2NG4SH3
					More data for this Ligand-Target Pair