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BDBM29683 MLS000666106::N-[3-cyano-1-(2-furanylmethyl)-5-oxo-2-dipyrido[1,2-d:3',4'-f]pyrimidinylidene]-2-furancarboxamide::N-[3-cyano-1-(2-furfuryl)-5-keto-dipyrido[1,2-d:3',4'-f]pyrimidin-2-ylidene]-2-furamide::N-[3-cyano-1-(2-furylmethyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidin-2-ylidene]-2-furamide::N-[3-cyano-1-(furan-2-ylmethyl)-5-oxidanylidene-dipyrido[1,2-d:3',4'-f]pyrimidin-2-ylidene]furan-2-carboxamide::N-[3-cyano-1-(furan-2-ylmethyl)-5-oxodipyrido[1,2-d:3',4'-f]pyrimidin-2-ylidene]furan-2-carboxamide::SMR000271415::cid_1279881

SMILES: O=C(\N=c1/c(cc2c(nc3ccccn3c2=O)n1Cc1ccco1)C#N)c1ccco1

InChI Key: InChIKey=YTKDDTDTKZGUHJ-NCELDCMTSA-N

Data: 2 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 2 hits for monomerid = 29683   
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
Runt-Related Transcription Factor 1 Isoform AML1C


(Homo sapiens (Human))
BDBM29683
PNG
(MLS000666106 | N-[3-cyano-1-(2-furanylmethyl)-5-ox...)
Show SMILES O=C(\N=c1/c(cc2c(nc3ccccn3c2=O)n1Cc1ccco1)C#N)c1ccco1
Show InChI InChI=1S/C22H13N5O4/c23-12-14-11-16-20(24-18-7-1-2-8-26(18)22(16)29)27(13-15-5-3-9-30-15)19(14)25-21(28)17-6-4-10-31-17/h1-11H,13H2/b25-19+
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 5.61E+4n/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))
BDBM29683
PNG
(MLS000666106 | N-[3-cyano-1-(2-furanylmethyl)-5-ox...)
Show SMILES O=C(\N=c1/c(cc2c(nc3ccccn3c2=O)n1Cc1ccco1)C#N)c1ccco1
Show InChI InChI=1S/C22H13N5O4/c23-12-14-11-16-20(24-18-7-1-2-8-26(18)22(16)29)27(13-15-5-3-9-30-15)19(14)25-21(28)17-6-4-10-31-17/h1-11H,13H2/b25-19+
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 5.61E+4n/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/Q2T72FSX
More data for this
Ligand-Target Pair