BDBM50128329 CHEMBL3629009

SMILES CC(C)n1c(cc(n1)Nc2cc(ccn2)C(F)(F)F)C3CCNCC3

InChI Key InChIKey=VBUUATKGJOATLP-UHFFFAOYSA-N

Data  2 KI

PDB links: 1 PDB ID matches this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50128329   

TargetMitogen-activated protein kinase kinase kinase 12(Human)
Wuxi Apptec

Curated by ChEMBL

LigandBDBM50128329(CHEMBL3629009)Copy SMILESCopy InChI

Affinity DataKi:  145nMAssay Description:Inhibition of N-terminally GST- tagged human DLK catalytic domain (1 to 520 amino acids) using N-terminally HIS-tagged MKK4 K131M as substrate incuba...More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoCHEMBLPC cidPC sidPDBSimilars

In Depth
Date in BDB:
12/15/2016
Entry Details Article
Copy Entry DOIPubMedPDB3D Structure (crystal)
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TargetProtein delta homolog 1(Human)
Southwest Jiaotong University

Curated by ChEMBL

LigandBDBM50128329(CHEMBL3629009)Copy SMILESCopy InChI

Affinity DataKi:  145nMAssay Description:Binding affinity to DLK (unknown origin) assessed as inhibition constantMore data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoCHEMBLPC cidPC sidPDBSimilars

In Depth
Date in BDB:
12/14/2024
Entry Details
Copy Entry DOIPubMed
Copy Rxn URL