BindingDB logo
myBDB logout

null

SMILES: COC(=O)c1ccccc1OCCn1cnc2C(O)CNC=Nc12

InChI Key: InChIKey=JQEOPWAIJSYWPB-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50087384   
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))		BDBM50087384
PNG
(2-[2-(8-Hydroxy-7,8-dihydro-6H-imidazo[4,5-d][1,3]...)
Show SMILES COC(=O)c1ccccc1OCCn1cnc2C(O)CNC=Nc12 |c:22|
Show InChI InChI=1S/C16H18N4O4/c1-23-16(22)11-4-2-3-5-13(11)24-7-6-20-10-19-14-12(21)8-17-9-18-15(14)20/h2-5,9-10,12,21H,6-8H2,1H3,(H,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
 2.30E+3n/an/an/an/an/an/an/an/a



Metabasis Therapeutics Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against calf intestinal Adenosine deaminase (ADA)

J Med Chem 43: 1508-18 (2000)


BindingDB Entry DOI: 10.7270/Q2TB1645
More data for this
Ligand-Target Pair