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BDBM225276 2-[4-(4-Benzylpiperazin-1-yl)phenyl]-1H-benzo[d]imidazole (3d)

SMILES: C(N1CCN(CC1)c1ccc(cc1)-c1nc2ccccc2[nH]1)c1ccccc1

InChI Key: InChIKey=DAAKUAAOMGJRIE-UHFFFAOYSA-N

Data: 2 IC50

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 = 225276   
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
Acetylcholinesterase


(Homo sapiens (Human))
BDBM225276
PNG
(2-[4-(4-Benzylpiperazin-1-yl)phenyl]-1H-benzo[d]im...)
Show SMILES C(N1CCN(CC1)c1ccc(cc1)-c1nc2ccccc2[nH]1)c1ccccc1
Show InChI InChI=1S/C24H24N4/c1-2-6-19(7-3-1)18-27-14-16-28(17-15-27)21-12-10-20(11-13-21)24-25-22-8-4-5-9-23(22)26-24/h1-13H,14-18H2,(H,25,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 9.72E+4n/an/an/an/a8.025



Hacettepe University



Assay Description
Reactions were performed in a mediumcontaining substrate (0.05-0.4 mM) combined with 0.125 mM DTNB in 100 mM 3-(N-morpholino)propanesulfonic acid buf...


Bioorg Chem 72: 208-214 (2017)


BindingDB Entry DOI: 10.7270/Q2JM28HK
More data for this
Ligand-Target Pair
Butyrylcholinesterase (BChE)


(Equus caballus (Horse))
BDBM225276
PNG
(2-[4-(4-Benzylpiperazin-1-yl)phenyl]-1H-benzo[d]im...)
Show SMILES C(N1CCN(CC1)c1ccc(cc1)-c1nc2ccccc2[nH]1)c1ccccc1
Show InChI InChI=1S/C24H24N4/c1-2-6-19(7-3-1)18-27-14-16-28(17-15-27)21-12-10-20(11-13-21)24-25-22-8-4-5-9-23(22)26-24/h1-13H,14-18H2,(H,25,26)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 5.22E+3n/an/an/an/a8.025



Hacettepe University



Assay Description
Reactions were performed in a mediumcontaining substrate (0.05-0.4 mM) combined with 0.125 mM DTNB in 100 mM 3-(N-morpholino)propanesulfonic acid buf...


Bioorg Chem 72: 208-214 (2017)


BindingDB Entry DOI: 10.7270/Q2JM28HK
More data for this
Ligand-Target Pair