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BDBM74485 2-[4-[4-(4-methylphenyl)-1-piperazinyl]butyl]-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazole-1,3-dione;hydrochloride::2-[4-[4-(4-methylphenyl)piperazin-1-yl]butyl]-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazole-1,3-dione;hydrochloride::2-[4-[4-(p-tolyl)piperazino]butyl]-5,6,7,7a-tetrahydropyrrol[1,2-c]imidazole-1,3-quinone;hydrochloride::2-{4-[4-(4-methylphenyl)-1-piperazinyl]butyl}tetrahydro-1H-pyrrolo[1,2-c]imidazole-1,3(2H)-dione::MLS000756208::SMR000229960::cid_15944977

SMILES: Cc1ccc(cc1)N1CCN(CCCCN2C(=O)C3CCCN3C2=O)CC1

InChI Key: InChIKey=HRJHDAXXWFXELB-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 74485   
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
Hematopoietic cell protein-tyrosine phosphatase 70Z-PEP


(Homo sapiens (Human))
BDBM74485
PNG
(2-[4-[4-(4-methylphenyl)-1-piperazinyl]butyl]-5,6,...)
Show SMILES Cc1ccc(cc1)N1CCN(CCCCN2C(=O)C3CCCN3C2=O)CC1
Show InChI InChI=1S/C21H30N4O2/c1-17-6-8-18(9-7-17)23-15-13-22(14-16-23)10-2-3-11-25-20(26)19-5-4-12-24(19)21(25)27/h6-9,19H,2-5,10-16H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>7.94E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q24748BK
More data for this
Ligand-Target Pair
Hematopoietic cell protein-tyrosine phosphatase 70Z-PEP


(Homo sapiens (Human))
BDBM74485
PNG
(2-[4-[4-(4-methylphenyl)-1-piperazinyl]butyl]-5,6,...)
Show SMILES Cc1ccc(cc1)N1CCN(CCCCN2C(=O)C3CCCN3C2=O)CC1
Show InChI InChI=1S/C21H30N4O2/c1-17-6-8-18(9-7-17)23-15-13-22(14-16-23)10-2-3-11-25-20(26)19-5-4-12-24(19)21(25)27/h6-9,19H,2-5,10-16H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>7.94E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2CR5RTC
More data for this
Ligand-Target Pair
Hematopoietic protein-tyrosine phosphatase (HEPTP)


(Homo sapiens (Human))
BDBM74485
PNG
(2-[4-[4-(4-methylphenyl)-1-piperazinyl]butyl]-5,6,...)
Show SMILES Cc1ccc(cc1)N1CCN(CCCCN2C(=O)C3CCCN3C2=O)CC1
Show InChI InChI=1S/C21H30N4O2/c1-17-6-8-18(9-7-17)23-15-13-22(14-16-23)10-2-3-11-25-20(26)19-5-4-12-24(19)21(25)27/h6-9,19H,2-5,10-16H2,1H3
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>7.94E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2VQ314Z
More data for this
Ligand-Target Pair