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2 similar compounds to monomer 50011591

Compile data set for download or QSAR
Wt: 264.2
BDBM50281613
Wt: 261.3
BDBM50028245

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50281613,50028245   
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
Adenosine deaminase


(Bos taurus (bovine))
BDBM50028245
PNG
(3-Imidazo[4,5-b]pyridin-3-yl-nonan-2-ol | CHEMBL96...)
Show SMILES CCCCCCC(C(C)O)n1cnc2cccnc12
Show InChI InChI=1S/C15H23N3O/c1-3-4-5-6-9-14(12(2)19)18-11-17-13-8-7-10-16-15(13)18/h7-8,10-12,14,19H,3-6,9H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
550n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against calf intestine adenosine deaminase enzyme


J Med Chem 27: 274-8 (1984)


Article DOI: 10.1021/jm00369a008
BindingDB Entry DOI: 10.7270/Q2CR5TW3
More data for this
Ligand-Target Pair
Adenosylhomocysteinase


(Homo sapiens (Human))
BDBM50281613
PNG
(3-(4-Amino-imidazo[4,5-c]pyridin-1-yl)-5-hydroxyme...)
Show SMILES Nc1ccnc2n(cnc12)[C@@H]1C[C@H](CO)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C12H16N4O3/c13-7-1-2-14-12-9(7)15-5-16(12)8-3-6(4-17)10(18)11(8)19/h1-2,5-6,8,10-11,17-19H,3-4H2,(H2,13,14)/t6-,8-,10-,11+/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 18n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tested for inhibitory concentration against S-adenosyl-homocysteine hydrolase


Bioorg Med Chem Lett 3: 663-666 (1993)


Article DOI: 10.1016/S0960-894X(01)81249-X
BindingDB Entry DOI: 10.7270/Q2X92BS9
More data for this
Ligand-Target Pair