BindingDB logo
myBDB logout

BDBM50087292 3-(2-Hydroxy-ethyl)-3,6,7,8-tetrahydro-imidazo[4,5-d][1,3]diazepin-8-ol::CHEMBL36879

SMILES: OCCn1cnc2C(O)CNC=Nc12

InChI Key: InChIKey=GKYZNVMIMBRQBH-UHFFFAOYSA-N

Data: 2 KI

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 2 hits for monomerid = 50087292   
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))
BDBM50087292
PNG
(3-(2-Hydroxy-ethyl)-3,6,7,8-tetrahydro-imidazo[4,5...)
Show SMILES OCCn1cnc2C(O)CNC=Nc12 |c:11|
Show InChI InChI=1S/C8H12N4O2/c13-2-1-12-5-11-7-6(14)3-9-4-10-8(7)12/h4-6,13-14H,1-3H2,(H,9,10)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

PubMed
>7.50E+3n/an/an/an/an/an/an/an/a



Metabasis Therapeutics Inc.

Curated by ChEMBL


Assay Description
Evaluated for the inhibition of calf intestinal Adenosine deaminase (ADA)


J Med Chem 43: 1495-507 (2000)


BindingDB Entry DOI: 10.7270/Q2Z31XWJ
More data for this
Ligand-Target Pair
AMP deaminase 2


(Homo sapiens (Human))
BDBM50087292
PNG
(3-(2-Hydroxy-ethyl)-3,6,7,8-tetrahydro-imidazo[4,5...)
Show SMILES OCCn1cnc2C(O)CNC=Nc12 |c:11|
Show InChI InChI=1S/C8H12N4O2/c13-2-1-12-5-11-7-6(14)3-9-4-10-8(7)12/h4-6,13-14H,1-3H2,(H,9,10)
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
1.50E+5n/an/an/an/an/an/an/an/a



Metabasis Therapeutics Inc.

Curated by ChEMBL


Assay Description
Evaluated for the inhibition of porcine heart or human L-type Adenosine 5'-monophosphate deaminase (AMPDA)


J Med Chem 43: 1495-507 (2000)


BindingDB Entry DOI: 10.7270/Q2Z31XWJ
More data for this
Ligand-Target Pair