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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenylate kinase 3 alpha like 1' and Ligand = 'BDBM50367073'   
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
Adenylate kinase 3 alpha like 1


(Rattus norvegicus)
BDBM50367073
PNG
(CHEMBL3350528 | CHEMBL609819)
Show SMILES CN(CCCCCCN(C)c1ncnc2n(cnc12)[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]1O)C(=O)CCCCCNC(=O)CI
Show InChI InChI=1/C26H45IN7O15P3/c1-32(20(36)10-6-5-7-11-28-19(35)14-27)12-8-3-4-9-13-33(2)24-21-25(30-16-29-24)34(17-31-21)26-23(38)22(37)18(47-26)15-46-51(42,43)49-52(44,45)48-50(39,40)41/h16-18,22-23,26,37-38H,3-15H2,1-2H3,(H,28,35)(H,42,43)(H,44,45)(H2,39,40,41)/t18-,22-,23-,26-/s2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
2.40E+6n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to inhibit rat adenylate kinase III, activity expressed as Inhibition constant; Competitive inhibition


J Med Chem 25: 382-6 (1982)


Article DOI: 10.1021/jm00346a010
BindingDB Entry DOI: 10.7270/Q24F1R9V
More data for this
Ligand-Target Pair