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BDBM74508 3-(2-chlorophenyl)-5-methyl-N-[1-[3-(2-methylpropanoylamino)phenyl]ethylideneamino]-1,2-oxazole-4-carboxamide::3-(2-chlorophenyl)-5-methyl-N-[1-[3-[(2-methyl-1-oxopropyl)amino]phenyl]ethylideneamino]-4-isoxazolecarboxamide::3-(2-chlorophenyl)-N-[1-[3-(isobutyrylamino)phenyl]ethylideneamino]-5-methyl-isoxazole-4-carboxamide::MLS000699659::N-[3-(N-{[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]carbonyl}ethanehydrazonoyl)phenyl]-2-methylpropanamide::SMR000227444::cid_1223922

SMILES: CC(C)C(=O)Nc1cccc(c1)C(C)=NNC(=O)c1c(C)onc1-c1ccccc1Cl

InChI Key: InChIKey=QPOGYCGYTXQWMC-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 = 74508   
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 22


(Homo sapiens (Human))
BDBM74508
PNG
(3-(2-chlorophenyl)-5-methyl-N-[1-[3-(2-methylpropa...)
Show SMILES CC(C)C(=O)Nc1cccc(c1)C(C)=NNC(=O)c1c(C)onc1-c1ccccc1Cl |w:14.15|
Show InChI InChI=1S/C23H23ClN4O3/c1-13(2)22(29)25-17-9-7-8-16(12-17)14(3)26-27-23(30)20-15(4)31-28-21(20)18-10-5-6-11-19(18)24/h5-13H,1-4H3,(H,25,29)(H,27,30)
PDB

UniProtKB/SwissProt

antibodypedia
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PC cid
PC sid
UniChem
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
Tyrosine-protein phosphatase non-receptor type 22


(Homo sapiens (Human))
BDBM74508
PNG
(3-(2-chlorophenyl)-5-methyl-N-[1-[3-(2-methylpropa...)
Show SMILES CC(C)C(=O)Nc1cccc(c1)C(C)=NNC(=O)c1c(C)onc1-c1ccccc1Cl |w:14.15|
Show InChI InChI=1S/C23H23ClN4O3/c1-13(2)22(29)25-17-9-7-8-16(12-17)14(3)26-27-23(30)20-15(4)31-28-21(20)18-10-5-6-11-19(18)24/h5-13H,1-4H3,(H,25,29)(H,27,30)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem
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
Tyrosine-protein phosphatase non-receptor type 7


(Homo sapiens (Human))
BDBM74508
PNG
(3-(2-chlorophenyl)-5-methyl-N-[1-[3-(2-methylpropa...)
Show SMILES CC(C)C(=O)Nc1cccc(c1)C(C)=NNC(=O)c1c(C)onc1-c1ccccc1Cl |w:14.15|
Show InChI InChI=1S/C23H23ClN4O3/c1-13(2)22(29)25-17-9-7-8-16(12-17)14(3)26-27-23(30)20-15(4)31-28-21(20)18-10-5-6-11-19(18)24/h5-13H,1-4H3,(H,25,29)(H,27,30)
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
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