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BDBM50380839 CHEMBL2018359

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

InChI Key: InChIKey=JZNDGRXEKKEXAU-XUESUEPENA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50380839   
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))
BDBM50380839
PNG
(CHEMBL2018359)
Show SMILES CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC(CC1)N1Cc2ccccc2NC1=O)C(=O)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1/C32H48N6O5/c1-32(2,3)43-31(42)34-27(29(40)37-19-11-24(12-20-37)35-15-7-4-8-16-35)21-28(39)36-17-13-25(14-18-36)38-22-23-9-5-6-10-26(23)33-30(38)41/h5-6,9-10,24-25,27H,4,7-8,11-22H2,1-3H3,(H,33,41)(H,34,42)/t27-/s2
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MMDB

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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 590n/an/an/an/an/an/a



Bristol-Myers Squibb Research & Development

Curated by ChEMBL


Assay Description
Displacement of [125]CGRP from human CGRP receptor expressed in human SK-N-MC cell membrane after 2 hrs by scintillation counting


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