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SMILES: FC(F)(F)c1cc2Nc3nc(NCCC\C=C/COc(c2)c1)nc(n3)-c1cccc(n1)C(F)(F)F

InChI Key:

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 = 50555755   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Isocitrate dehydrogenase [NADP], mitochondrial


(Homo sapiens (Human))
BDBM50555755
PNG
(CHEMBL4786020)
Show SMILES FC(F)(F)c1cc2Nc3nc(NCCC\C=C/COc(c2)c1)nc(n3)-c1cccc(n1)C(F)(F)F |c:15|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 17n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP], mitochondrial


(Homo sapiens (Human))
BDBM50555755
PNG
(CHEMBL4786020)
Show SMILES FC(F)(F)c1cc2Nc3nc(NCCC\C=C/COc(c2)c1)nc(n3)-c1cccc(n1)C(F)(F)F |c:15|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a>2.00E+4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP], mitochondrial


(Homo sapiens (Human))
BDBM50555755
PNG
(CHEMBL4786020)
Show SMILES FC(F)(F)c1cc2Nc3nc(NCCC\C=C/COc(c2)c1)nc(n3)-c1cccc(n1)C(F)(F)F |c:15|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 50n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair