null

SMILES COc1ccc(cc1)S(=O)(=O)n1c(N)c(C#N)c(c1C(=O)c1ccccc1)-c1cncc(Br)c1

InChI Key InChIKey=XRADRZDQIKIIFA-UHFFFAOYSA-N

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 13 hits for monomerid = 54689   

TargetRas-related protein Rab-7a(Canis lupus familiaris)
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM54689(2-amino-5-benzoyl-4-(5-bromo-3-pyridinyl)-1-(4-met...)copy SMILEScopy InChI
Affinity DataKi:  540nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2SB445MPCBioAssay
LigandPNGBDBM54689(2-amino-5-benzoyl-4-(5-bromo-3-pyridinyl)-1-(4-met...)copy SMILEScopy InChI
Affinity DataKi:  920nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2RB7317PCBioAssay
LigandPNGBDBM54689(2-amino-5-benzoyl-4-(5-bromo-3-pyridinyl)-1-(4-met...)copy SMILEScopy InChI
Affinity DataKi:  1.06E+3nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q20V8B7JPCBioAssay
TargetCell division control protein 42 homolog(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM54689(2-amino-5-benzoyl-4-(5-bromo-3-pyridinyl)-1-(4-met...)copy SMILEScopy InChI
Affinity DataKi:  1.54E+3nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q22R3Q30PCBioAssay
TargetCell division control protein 42 homolog(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM54689(2-amino-5-benzoyl-4-(5-bromo-3-pyridinyl)-1-(4-met...)copy SMILEScopy InChI
Affinity DataKi:  4.81E+3nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2TB15BFPCBioAssay
LigandPNGBDBM54689(2-amino-5-benzoyl-4-(5-bromo-3-pyridinyl)-1-(4-met...)copy SMILEScopy InChI
Affinity DataEC50:  1.17E+4nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q24M92ZVPCBioAssay
LigandPNGBDBM54689(2-amino-5-benzoyl-4-(5-bromo-3-pyridinyl)-1-(4-met...)copy SMILEScopy InChI
Affinity DataEC50:  9.84E+3nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2W37TR5PCBioAssay
TargetGTPase KRas [1-37](Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM54689(2-amino-5-benzoyl-4-(5-bromo-3-pyridinyl)-1-(4-met...)copy SMILEScopy InChI
Affinity DataEC50:  3.00E+4nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2D21W1MPCBioAssay
TargetCell division control protein 42 homolog(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM54689(2-amino-5-benzoyl-4-(5-bromo-3-pyridinyl)-1-(4-met...)copy SMILEScopy InChI
Affinity DataEC50:  2.28E+4nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2Z31X2SPCBioAssay
TargetCell division control protein 42 homolog(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM54689(2-amino-5-benzoyl-4-(5-bromo-3-pyridinyl)-1-(4-met...)copy SMILEScopy InChI
Affinity DataEC50:  9.98E+3nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q26H4FT9PCBioAssay
TargetRas-related protein Rab-2A(Canis lupus familiaris)
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM54689(2-amino-5-benzoyl-4-(5-bromo-3-pyridinyl)-1-(4-met...)copy SMILEScopy InChI
Affinity DataEC50:  3.00E+4nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2V40SNSPCBioAssay
TargetGTPase KRas [1-37](Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM54689(2-amino-5-benzoyl-4-(5-bromo-3-pyridinyl)-1-(4-met...)copy SMILEScopy InChI
Affinity DataEC50:  3.00E+4nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q23N21VGPCBioAssay
TargetRas-related protein Rab-7a(Canis lupus familiaris)
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM54689(2-amino-5-benzoyl-4-(5-bromo-3-pyridinyl)-1-(4-met...)copy SMILEScopy InChI
Affinity DataEC50:  8.24E+3nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2X34VWJPCBioAssay