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BDBM119125 GS4

SMILES: CC(C)c1nc(cs1)CN(C)C(=O)N[C@@H](C(C)C)C(=O)NCCCCNC(=O)OCc2cncs2

InChI Key: InChIKey=OWSUPSVMUSHQHC-UHFFFAOYSA-N

Data: 1 IC50  2 Kd

PDB links: 1 PDB ID matches this monomer.

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 3 hits for monomerid = 119125   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cytochrome P450 3A4


(Human)
BDBM119125
PNG
(GS4)
GoogleScholar
UniChem
n/an/a 1.50E+4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cytochrome P450 3A4


(Human)
BDBM119125
PNG
(GS4)
GoogleScholar
UniChem
n/an/an/a 1.50E+3n/an/an/a7.4n/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cytochrome P450 3A4


(Human)
BDBM119125
PNG
(GS4)
GoogleScholar
UniChem
n/an/an/a 1.31E+4n/an/an/a7.4n/a


TBA



Citation and Details
More data for this
Ligand-Target Pair