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BDBM50387506 CHEMBL2059806

SMILES: NC(=O)CC[C@@H](NC(=O)N1CCC(CC1)n1c2ccccc2[nH]c1=O)C(=O)N1CCC(CC1)N1CCCCC1

InChI Key: InChIKey=SRWGCEBIRDSIDK-HSZRJFAPSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50387506   
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))
BDBM50387506
PNG
(CHEMBL2059806)
Show SMILES NC(=O)CC[C@@H](NC(=O)N1CCC(CC1)n1c2ccccc2[nH]c1=O)C(=O)N1CCC(CC1)N1CCCCC1 |r|
Show InChI InChI=1S/C28H41N7O4/c29-25(36)9-8-23(26(37)33-16-10-20(11-17-33)32-14-4-1-5-15-32)31-27(38)34-18-12-21(13-19-34)35-24-7-3-2-6-22(24)30-28(35)39/h2-3,6-7,20-21,23H,1,4-5,8-19H2,(H2,29,36)(H,30,39)(H,31,38)/t23-/m1/s1
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MMDB

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PC sid
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Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Research& Development

Curated by ChEMBL


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


Bioorg Med Chem Lett 22: 4723-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.05.074
BindingDB Entry DOI: 10.7270/Q2SN0B1W
More data for this
Ligand-Target Pair