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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cholecystokinin' and Ligand = 'BDBM82387'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Cholecystokinin


(RAT)
BDBM82387
PNG
(CCK antagonist synthetic 22)
Show SMILES CN1c2ccc(F)cc2C(=NC(NC(=O)c2cc3ccccc3[nH]2)C1=O)c1ccccc1 |c:10|
Show InChI InChI=1S/C25H19FN4O2/c1-30-21-12-11-17(26)14-18(21)22(15-7-3-2-4-8-15)28-23(25(30)32)29-24(31)20-13-16-9-5-6-10-19(16)27-20/h2-14,23,27H,1H3,(H,29,31)
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PC cid
PC sid
UniChem

Similars

Article
PubMed
1.40n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Research Laboratories

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 83: 4918-22 (1986)


Article DOI: 10.1073/pnas.83.13.4918
BindingDB Entry DOI: 10.7270/Q2445K05
More data for this
Ligand-Target Pair