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SMILES: Oc1c(Cl)c(N=CCN2CCOCC2)c(O)c2cnncc12

InChI Key: InChIKey=SXGOIZBTYCPGNH-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50106503   
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
Tyrosine-protein phosphatase non-receptor type 1


(Homo sapiens (Human))
BDBM50106503
PNG
(6-Chloro-7-(2-morpholin-4-yl-ethylamino)-phthalazi...)
Show SMILES Oc1c(Cl)c(N=CCN2CCOCC2)c(O)c2cnncc12 |w:6.6|
Show InChI InChI=1S/C14H15ClN4O3/c15-11-12(16-1-2-19-3-5-22-6-4-19)14(21)10-8-18-17-7-9(10)13(11)20/h1,7-8,20-21H,2-6H2
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
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AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 9.80E+3n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Inhibitory Activity against Recombinant Human PTP1


J Med Chem 44: 4042-9 (2001)


BindingDB Entry DOI: 10.7270/Q2X34WR5
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase 3


(Homo sapiens (Human))
BDBM50106503
PNG
(6-Chloro-7-(2-morpholin-4-yl-ethylamino)-phthalazi...)
Show SMILES Oc1c(Cl)c(N=CCN2CCOCC2)c(O)c2cnncc12 |w:6.6|
Show InChI InChI=1S/C14H15ClN4O3/c15-11-12(16-1-2-19-3-5-22-6-4-19)14(21)10-8-18-17-7-9(10)13(11)20/h1,7-8,20-21H,2-6H2
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 1.10E+3n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Inhibitory Activity against Recombinant Human VHR


J Med Chem 44: 4042-9 (2001)


BindingDB Entry DOI: 10.7270/Q2X34WR5
More data for this
Ligand-Target Pair
M-phase inducer phosphatase 2


(Homo sapiens (Human))
BDBM50106503
PNG
(6-Chloro-7-(2-morpholin-4-yl-ethylamino)-phthalazi...)
Show SMILES Oc1c(Cl)c(N=CCN2CCOCC2)c(O)c2cnncc12 |w:6.6|
Show InChI InChI=1S/C14H15ClN4O3/c15-11-12(16-1-2-19-3-5-22-6-4-19)14(21)10-8-18-17-7-9(10)13(11)20/h1,7-8,20-21H,2-6H2
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 430n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human cell division cycle 25B


J Med Chem 44: 4042-9 (2001)


BindingDB Entry DOI: 10.7270/Q2X34WR5
More data for this
Ligand-Target Pair