BDBM50553480 CHEMBL4741442

SMILES C[C@H](CO)Nc1nc(Nc2ccc(cc2)S(N)(=O)=O)ncc1Br

InChI Key InChIKey=MJIALGDLOLWBRQ-UHFFFAOYSA-N

Data  24 IC50

PDB links: 1 PDB ID matches this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 24 hits for monomerid = 50553480   

TargetVascular endothelial growth factor receptor 2(Human)
The People'S Hospital of Xinjiang Uyghur Autonomous Region

Curated by ChEMBL

LigandBDBM50553480(CHEMBL4741442)Copy SMILESCopy InChI

Affinity DataIC50: 34nMAssay Description:Inhibition of VEGFR2 (unknown origin)More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidPDBSimilars

In DepthDetails
Copy BDB DOIPubMed
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TargetCyclin-dependent kinase 7(Human)
Nankai University

Curated by ChEMBL

LigandBDBM50553480(CHEMBL4741442)Copy SMILESCopy InChI

Affinity DataIC50: 85nMAssay Description:Inhibition of CDK7 (unknown origin)More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidPDBSimilars

In DepthDetails
Copy BDB DOIPubMed
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TargetCyclin-dependent kinase 4(Human)
Nankai University

Curated by ChEMBL

LigandBDBM50553480(CHEMBL4741442)Copy SMILESCopy InChI

Affinity DataIC50: 61nMAssay Description:Inhibition of CDK4 (unknown origin)More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidPDBSimilars

In DepthDetails
Copy BDB DOIPubMed
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TargetCyclin-dependent kinase 2(Human)
Nankai University

Curated by ChEMBL

LigandBDBM50553480(CHEMBL4741442)Copy SMILESCopy InChI

Affinity DataIC50: 4nMAssay Description:Inhibition of CDK2 (unknown origin)More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidPDBSimilars

In DepthDetails
Copy BDB DOIPubMedPDB3D Structure (crystal)
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TargetCyclin-dependent kinase 1(Human)
Nankai University

Curated by ChEMBL

LigandBDBM50553480(CHEMBL4741442)Copy SMILESCopy InChI

Affinity DataIC50: 50nMAssay Description:Inhibition of CDK1 (unknown origin)More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidPDBSimilars

In DepthDetails
Copy BDB DOIPubMed
Copy reaction URL

TargetCyclin-dependent kinase 9(Human)
Nankai University

Curated by ChEMBL

LigandBDBM50553480(CHEMBL4741442)Copy SMILESCopy InChI

Affinity DataIC50: 5nMAssay Description:Inhibition of CDK9 (unknown origin)More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidPDBSimilars

In DepthDetails
Copy BDB DOIPubMed
Copy reaction URL

TargetCyclin-dependent kinase 4(Human)
Nankai University

Curated by ChEMBL

LigandBDBM50553480(CHEMBL4741442)Copy SMILESCopy InChI

Affinity DataIC50: 61nMAssay Description:Inhibition of CDK4 (unknown origin)More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidPDBSimilars

In DepthDetails
Copy BDB DOIPubMed
Copy reaction URL

TargetCyclin-dependent kinase 7(Human)
Nankai University

Curated by ChEMBL

LigandBDBM50553480(CHEMBL4741442)Copy SMILESCopy InChI

Affinity DataIC50: 85nMAssay Description:Inhibition of CDK7 (unknown origin)More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidPDBSimilars

In DepthDetails
Copy BDB DOIPubMed
Copy reaction URL

TargetCyclin-dependent kinase 9(Human)
Nankai University

Curated by ChEMBL

LigandBDBM50553480(CHEMBL4741442)Copy SMILESCopy InChI

Affinity DataIC50: 5nMAssay Description:Inhibition of CDK9 (unknown origin)More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidPDBSimilars

In DepthDetails
Copy BDB DOIPubMed
Copy reaction URL

TargetCyclin-dependent kinase 2(Human)
Nankai University

Curated by ChEMBL

LigandBDBM50553480(CHEMBL4741442)Copy SMILESCopy InChI

Affinity DataIC50: 4nMAssay Description:Inhibition of CDK2 (unknown origin)More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidPDBSimilars

In DepthDetails
Copy BDB DOIPubMedPDB3D Structure (crystal)
Copy reaction URL

TargetCyclin-dependent kinase 1(Human)
Nankai University

Curated by ChEMBL

LigandBDBM50553480(CHEMBL4741442)Copy SMILESCopy InChI

Affinity DataIC50: 50nMAssay Description:Inhibition of CDK1 (unknown origin)More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidPDBSimilars

In DepthDetails
Copy BDB DOIPubMed
Copy reaction URL

TargetCarbonic anhydrase 2(Human)
The People'S Hospital of Xinjiang Uyghur Autonomous Region

Curated by ChEMBL

LigandBDBM50553480(CHEMBL4741442)Copy SMILESCopy InChI

Affinity DataIC50: 514nMAssay Description:Inhibition of recombinant human CA-II using 4-nitrophenylacetate as substrate by spectrophotometryMore data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidPDBSimilars

In DepthDetails
Copy BDB DOIPubMed
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TargetCyclin-dependent kinase/G2/mitotic-specific cyclin- 1(Human)
Endotherm

Curated by ChEMBL

LigandBDBM50553480(CHEMBL4741442)Copy SMILESCopy InChI

Affinity DataIC50: 50nMAssay Description:Inhibition of GST-tagged recombinant human CDK1/GST-tagged human cyclin B expressed in Sf-9 cells incubated for 10 mins by scintillation counting met...More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidPDBSimilars

In DepthDetails Article
Copy BDB DOIPubMed
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TargetCyclin-T1/Cyclin-dependent kinase 9(Human)
The People'S Hospital of Xinjiang Uyghur Autonomous Region

Curated by ChEMBL

LigandBDBM50553480(CHEMBL4741442)Copy SMILESCopy InChI

Affinity DataIC50: 5nMAssay Description:Inhibition of CDK9/Cyclin T1 (unknown origin)More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidPDBSimilars

In DepthDetails
Copy BDB DOIPubMed
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TargetCyclin-H/Cyclin-dependent kinase 7(Human)
The People'S Hospital of Xinjiang Uyghur Autonomous Region

Curated by ChEMBL

LigandBDBM50553480(CHEMBL4741442)Copy SMILESCopy InChI

Affinity DataIC50: 85nMAssay Description:Inhibition of CDK7/Cyclin H (unknown origin)More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidPDBSimilars

In DepthDetails
Copy BDB DOIPubMed
Copy reaction URL

TargetCyclin-dependent kinase 4/G1/S-specific cyclin-D1(Human)
The People'S Hospital of Xinjiang Uyghur Autonomous Region

Curated by ChEMBL

LigandBDBM50553480(CHEMBL4741442)Copy SMILESCopy InChI

Affinity DataIC50: 61nMAssay Description:Inhibition of CDK4/Cyclin D1 (unknown origin)More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidPDBSimilars

In DepthDetails
Copy BDB DOIPubMed
Copy reaction URL

TargetCyclin-dependent kinase 9(Human)
Nankai University

Curated by ChEMBL

LigandBDBM50553480(CHEMBL4741442)Copy SMILESCopy InChI

Affinity DataIC50: 5nMAssay Description:Inhibition of CDK9 (unknown origin)More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidPDBSimilars

In DepthDetails Article
Copy BDB DOIPubMed
Copy reaction URL

TargetCyclin-dependent kinase 7(Human)
Nankai University

Curated by ChEMBL

LigandBDBM50553480(CHEMBL4741442)Copy SMILESCopy InChI

Affinity DataIC50: 85nMAssay Description:Inhibition of CDK7 (unknown origin)More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidPDBSimilars

In DepthDetails Article
Copy BDB DOIPubMed
Copy reaction URL

TargetCyclin-dependent kinase 4(Human)
Nankai University

Curated by ChEMBL

LigandBDBM50553480(CHEMBL4741442)Copy SMILESCopy InChI

Affinity DataIC50: 61nMAssay Description:Inhibition of CDK4 (unknown origin)More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidPDBSimilars

In DepthDetails Article
Copy BDB DOIPubMed
Copy reaction URL

TargetCyclin-dependent kinase 2(Human)
Nankai University

Curated by ChEMBL

LigandBDBM50553480(CHEMBL4741442)Copy SMILESCopy InChI

Affinity DataIC50: 4nMAssay Description:Inhibition of CDK2 (unknown origin)More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidPDBSimilars

In DepthDetails Article
Copy BDB DOIPubMedPDB3D Structure (crystal)
Copy reaction URL

TargetCyclin-dependent kinase 1(Human)
Nankai University

Curated by ChEMBL

LigandBDBM50553480(CHEMBL4741442)Copy SMILESCopy InChI

Affinity DataIC50: 50nMAssay Description:Inhibition of CDK1 (unknown origin)More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidPDBSimilars

In DepthDetails Article
Copy BDB DOIPubMed
Copy reaction URL

TargetCarbonic anhydrase 2(Human)
The People'S Hospital of Xinjiang Uyghur Autonomous Region

Curated by ChEMBL

LigandBDBM50553480(CHEMBL4741442)Copy SMILESCopy InChI

Affinity DataIC50: 514nMAssay Description:Inhibition of human carbonic anhydrase 2 using 4-nitrophenyl acetate as substrate by spectrophotometryMore data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidPDBSimilars

In DepthDetails Article
Copy BDB DOIPubMed
Copy reaction URL

TargetVascular endothelial growth factor receptor 2(Human)
The People'S Hospital of Xinjiang Uyghur Autonomous Region

Curated by ChEMBL

LigandBDBM50553480(CHEMBL4741442)Copy SMILESCopy InChI

Affinity DataIC50: 34nMAssay Description:Inhibition of GST-tagged recombinant human VEGFR2 expressed in Sf-9 cells incubated for 10 mins by scintillation counting methodMore data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidPDBSimilars

In DepthDetails Article
Copy BDB DOIPubMed
Copy reaction URL

TargetCyclin-dependent kinase 2/G1/S-specific cyclin-E1(Human)
Endotherm

Curated by ChEMBL

LigandBDBM50553480(CHEMBL4741442)Copy SMILESCopy InChI

Affinity DataIC50: 4nMAssay Description:Inhibition of GST-tagged recombinant human CDK2/GST-tagged human cyclin E expressed in Sf-9 cells incubated for 10 mins by scintillation counting met...More data for this Ligand-Target Pair

Target InfoPDB
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPC cidPC sidPDBSimilars

In DepthDetails Article
Copy BDB DOIPubMedPDB3D Structure (crystal)
Copy reaction URL