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BDBM95035 2-(4-methylphenyl)-N-(3-pyridinylmethyl)-4-quinazolinamine::2-(4-methylphenyl)-N-(pyridin-3-ylmethyl)quinazolin-4-amine::MLS000550241::Pyridin-3-ylmethyl-(2-p-tolyl-quinazolin-4-yl)-amine::SMR000178038::[2-(p-tolyl)quinazolin-4-yl]-(3-pyridylmethyl)amine::cid_2790953

SMILES: Cc1ccc(cc1)-c1nc(NCc2cccnc2)c2ccccc2n1

InChI Key: InChIKey=WTZJBLLWLKFGEQ-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 = 95035   
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
Low molecular weight phosphotyrosine protein phosphatase


(Homo sapiens (Human))
BDBM95035
PNG
(2-(4-methylphenyl)-N-(3-pyridinylmethyl)-4-quinazo...)
Show SMILES Cc1ccc(cc1)-c1nc(NCc2cccnc2)c2ccccc2n1
Show InChI InChI=1S/C21H18N4/c1-15-8-10-17(11-9-15)20-24-19-7-3-2-6-18(19)21(25-20)23-14-16-5-4-12-22-13-16/h2-13H,14H2,1H3,(H,23,24,25)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
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Similars

PCBioAssay
n/an/a 8.04E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2GM85XC
More data for this
Ligand-Target Pair
Hematopoietic cell protein-tyrosine phosphatase 70Z-PEP


(Homo sapiens (Human))
BDBM95035
PNG
(2-(4-methylphenyl)-N-(3-pyridinylmethyl)-4-quinazo...)
Show SMILES Cc1ccc(cc1)-c1nc(NCc2cccnc2)c2ccccc2n1
Show InChI InChI=1S/C21H18N4/c1-15-8-10-17(11-9-15)20-24-19-7-3-2-6-18(19)21(25-20)23-14-16-5-4-12-22-13-16/h2-13H,14H2,1H3,(H,23,24,25)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>8.00E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2DN43N5
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase


(Homo sapiens (Human))
BDBM95035
PNG
(2-(4-methylphenyl)-N-(3-pyridinylmethyl)-4-quinazo...)
Show SMILES Cc1ccc(cc1)-c1nc(NCc2cccnc2)c2ccccc2n1
Show InChI InChI=1S/C21H18N4/c1-15-8-10-17(11-9-15)20-24-19-7-3-2-6-18(19)21(25-20)23-14-16-5-4-12-22-13-16/h2-13H,14H2,1H3,(H,23,24,25)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.37E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2JD4VDZ
More data for this
Ligand-Target Pair