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Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Runt-Related Transcription Factor 1 Isoform AML1C' and Ligand = 'BDBM29669'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Runt-Related Transcription Factor 1 Isoform AML1C


(Homo sapiens (Human))
BDBM29669
PNG
(MLS000585896 | N-(2-oxidanylidenebenzo[g][1,3]benz...)
Show SMILES O=C(N(c1cc2sc(=O)oc2c2ccccc12)S(=O)(=O)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C23H14N2O5S2/c26-22(15-7-6-12-24-14-15)25(32(28,29)16-8-2-1-3-9-16)19-13-20-21(30-23(27)31-20)18-11-5-4-10-17(18)19/h1-14H
PDB
MMDB

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UniChem

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PCBioAssay
n/an/a 1.00E+5n/an/an/an/a7.423



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
This assay is to use HTS to identify inhibitors of the protein-protein interaction between the RUNX1 Runt domain and CBFbeta-SMMHC, a potential thera...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2DV1H7P
More data for this
Ligand-Target Pair
Runt-Related Transcription Factor 1 Isoform AML1C


(Homo sapiens (Human))
BDBM29669
PNG
(MLS000585896 | N-(2-oxidanylidenebenzo[g][1,3]benz...)
Show SMILES O=C(N(c1cc2sc(=O)oc2c2ccccc12)S(=O)(=O)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C23H14N2O5S2/c26-22(15-7-6-12-24-14-15)25(32(28,29)16-8-2-1-3-9-16)19-13-20-21(30-23(27)31-20)18-11-5-4-10-17(18)19/h1-14H
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
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PC cid
PC sid
UniChem

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Article
PCBioAssay
n/an/a 1.00E+5n/an/an/an/a7.423



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
This assay is to identify inhibitors of the protein-protein interaction between the RUNX1 Runt domain and CBFbeta-SMMHC. This is accomplished by usin...


PubChem Bioassay (2009)


Article DOI: 10.1038/42506
BindingDB Entry DOI: 10.7270/Q2T72FSX
More data for this
Ligand-Target Pair
Runt-Related Transcription Factor 1 Isoform AML1C


(Homo sapiens (Human))
BDBM29669
PNG
(MLS000585896 | N-(2-oxidanylidenebenzo[g][1,3]benz...)
Show SMILES O=C(N(c1cc2sc(=O)oc2c2ccccc12)S(=O)(=O)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C23H14N2O5S2/c26-22(15-7-6-12-24-14-15)25(32(28,29)16-8-2-1-3-9-16)19-13-20-21(30-23(27)31-20)18-11-5-4-10-17(18)19/h1-14H
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.00E+5n/an/an/an/a7.423



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
This assay is to identify inhibitors of the protein-protein interaction between the RUNX1 Runt domain and CBFbeta-SMMHC. This is accomplished by usin...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q25D8Q6Q
More data for this
Ligand-Target Pair
Runt-Related Transcription Factor 1 Isoform AML1C


(Homo sapiens (Human))
BDBM29669
PNG
(MLS000585896 | N-(2-oxidanylidenebenzo[g][1,3]benz...)
Show SMILES O=C(N(c1cc2sc(=O)oc2c2ccccc12)S(=O)(=O)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C23H14N2O5S2/c26-22(15-7-6-12-24-14-15)25(32(28,29)16-8-2-1-3-9-16)19-13-20-21(30-23(27)31-20)18-11-5-4-10-17(18)19/h1-14H
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.00E+5n/an/an/an/a7.423



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
This assay is to identify inhibitors of the protein-protein interaction between the RUNX1 Runt domain and CBFbeta-SMMHC. This is accomplished by usin...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2959FWK
More data for this
Ligand-Target Pair