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SMILES: COc1cnc(C)nc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2cccc(F)c12

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 = 636001   
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
Serine/threonine-protein kinase PLK4


(Homo sapiens (Human))
BDBM636001
PNG
((1R,2S)-4'-fluoro-2-{3-[(5-methoxy-2-methylpyrimid...)
Show SMILES COc1cnc(C)nc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2cccc(F)c12
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 34.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM636001
PNG
((1R,2S)-4'-fluoro-2-{3-[(5-methoxy-2-methylpyrimid...)
Show SMILES COc1cnc(C)nc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2cccc(F)c12
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 591n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM636001
PNG
((1R,2S)-4'-fluoro-2-{3-[(5-methoxy-2-methylpyrimid...)
Show SMILES COc1cnc(C)nc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2cccc(F)c12
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 625n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair