BDBM50521662 CHEMBL4471788

SMILES CSCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)CNC1=O

InChI Key InChIKey=OERRCNVYAIESOS-UHFFFAOYSA-N

Data  2 Kd

  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 2 hits for monomerid = 50521662   

TargetSerine/threonine-protein kinase B-raf(Human)
University of South Carolina

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50521662BDBM50521662(CHEMBL4471788)
Affinity DataKd:  310nMAssay Description:Binding affinity to BRAF (unknown origin) by isothermal titration calorimetryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/23/2021
Entry Details Article
PubMed
TargetSerine/threonine-protein kinase B-raf(Human)
University of South Carolina

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50521662BDBM50521662(CHEMBL4471788)
Affinity DataKd:  460nMAssay Description:Binding affinity to BRAF (unknown origin) by intrinsic tryptophan fluorescence assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/23/2021
Entry Details Article
PubMed