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BDBM50380823 CHEMBL2018491

SMILES: Clc1ccccc1NC(=O)N[C@@H](CC(=O)N1CCC(CC1)N1Cc2ccccc2NC1=O)C(=O)N1CCC(CC1)N1CCCCC1

InChI Key: InChIKey=WQUYPYLNEWHEQN-PMERELPUSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50380823   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Calcitonin gene-related peptide type 1 receptor


(Homo sapiens (Human))		BDBM50380823
PNG
(CHEMBL2018491)
Show SMILES Clc1ccccc1NC(=O)N[C@@H](CC(=O)N1CCC(CC1)N1Cc2ccccc2NC1=O)C(=O)N1CCC(CC1)N1CCCCC1 |r|
Show InChI InChI=1S/C34H44ClN7O4/c35-27-9-3-5-11-29(27)36-33(45)37-30(32(44)41-20-12-25(13-21-41)39-16-6-1-7-17-39)22-31(43)40-18-14-26(15-19-40)42-23-24-8-2-4-10-28(24)38-34(42)46/h2-5,8-11,25-26,30H,1,6-7,12-23H2,(H,38,46)(H2,36,37,45)/t30-/m0/s1
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PubMed
n/an/a 100n/an/an/an/an/an/a



Bristol-Myers Squibb Research& Development

Curated by ChEMBL


Assay Description
Antagonist activity at human CGRP receptor expressed in human SK-N-MC cells assessed as inhibition of CGRP-stimulated cAMP production

Bioorg Med Chem Lett 22: 2912-6 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.066
BindingDB Entry DOI: 10.7270/Q2SN0B0F
More data for this
Ligand-Target Pair