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BDBM50321031 CHEMBL1164183::Tyr-c[D-cys-Phe-D-Cys]-NH2

SMILES: N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]1CSSC[C@@H](NC(=O)[C@H](Cc2ccccc2)NC1=O)C(N)=O

InChI Key: InChIKey=GWIQBMQXSQTVNB-VNTMZGSJSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50321031   
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
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50321031
PNG
(CHEMBL1164183 | Tyr-c[D-cys-Phe-D-Cys]-NH2)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]1CSSC[C@@H](NC(=O)[C@H](Cc2ccccc2)NC1=O)C(N)=O |r|
Show InChI InChI=1S/C24H29N5O5S2/c25-17(10-15-6-8-16(30)9-7-15)22(32)29-20-13-36-35-12-19(21(26)31)28-23(33)18(27-24(20)34)11-14-4-2-1-3-5-14/h1-9,17-20,30H,10-13,25H2,(H2,26,31)(H,27,34)(H,28,33)(H,29,32)/t17-,18-,19+,20+/m0/s1
PDB

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PC cid
PC sid
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Similars

Article
PubMed
38.7n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Binding affinity to kappa opioid receptor


Bioorg Med Chem 18: 4446-52 (2010)


Article DOI: 10.1016/j.bmc.2010.04.069
BindingDB Entry DOI: 10.7270/Q23X87MV
More data for this
Ligand-Target Pair