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BDBM50087293 3-(5-Hydroxy-pentyl)-3,6,7,8-tetrahydro-imidazo[4,5-d][1,3]diazepin-8-ol::CHEMBL34373

SMILES: OCCCCCn1cnc2C(O)CNC=Nc12

InChI Key: InChIKey=HVFGWNIPZLNGQT-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 = 50087293   
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
AMP deaminase 2


(Homo sapiens (Human))
BDBM50087293
PNG
(3-(5-Hydroxy-pentyl)-3,6,7,8-tetrahydro-imidazo[4,...)
Show SMILES OCCCCCn1cnc2C(O)CNC=Nc12
Show InChI InChI=1S/C11H18N4O2/c16-5-3-1-2-4-15-8-14-10-9(17)6-12-7-13-11(10)15/h7-9,16-17H,1-6H2,(H,12,13)
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
3.60E+4n/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)


Article DOI: 10.1021/jm990447m
BindingDB Entry DOI: 10.7270/Q2Z31XWJ
More data for this
Ligand-Target Pair
Adenosine deaminase


(Bos taurus (bovine))
BDBM50087293
PNG
(3-(5-Hydroxy-pentyl)-3,6,7,8-tetrahydro-imidazo[4,...)
Show SMILES OCCCCCn1cnc2C(O)CNC=Nc12
Show InChI InChI=1S/C11H18N4O2/c16-5-3-1-2-4-15-8-14-10-9(17)6-12-7-13-11(10)15/h7-9,16-17H,1-6H2,(H,12,13)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
4.70E+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)


Article DOI: 10.1021/jm990447m
BindingDB Entry DOI: 10.7270/Q2Z31XWJ
More data for this
Ligand-Target Pair