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SMILES: Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2cc(cnc12)C1CC1

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 2 hits for monomerid = 50598855   
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
Membrane-associated tyrosine- and threonine-specific cdc2-inhibitory kinase


(Homo sapiens (Human))
BDBM50598855
PNG
(CHEMBL5190904)
Show SMILES Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2cc(cnc12)C1CC1 |(1.78,2.14,;2.68,1.29,;4.15,1.72,;5.27,.66,;4.9,-.84,;5.8,-1.69,;3.43,-1.27,;3.13,-2.47,;2.32,-.21,;.81,-.53,;.18,-1.94,;.8,-3.01,;-1.35,-1.78,;-2.38,-2.92,;-3.58,-2.67,;-1.99,-4.09,;-1.67,-.27,;-3,.5,;-3,2.04,;-1.67,2.81,;-.33,2.04,;-.33,.5,;-4.34,2.81,;-5.8,2.81,;-5.03,4.09,)|
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00552
BindingDB Entry DOI: 10.7270/Q2028WKQ
More data for this
Ligand-Target Pair
Membrane-associated tyrosine- and threonine-specific cdc2-inhibitory kinase


(Homo sapiens (Human))
BDBM50598855
PNG
(CHEMBL5190904)
Show SMILES Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2cc(cnc12)C1CC1 |(1.78,2.14,;2.68,1.29,;4.15,1.72,;5.27,.66,;4.9,-.84,;5.8,-1.69,;3.43,-1.27,;3.13,-2.47,;2.32,-.21,;.81,-.53,;.18,-1.94,;.8,-3.01,;-1.35,-1.78,;-2.38,-2.92,;-3.58,-2.67,;-1.99,-4.09,;-1.67,-.27,;-3,.5,;-3,2.04,;-1.67,2.81,;-.33,2.04,;-.33,.5,;-4.34,2.81,;-5.8,2.81,;-5.03,4.09,)|
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00552
BindingDB Entry DOI: 10.7270/Q2028WKQ
More data for this
Ligand-Target Pair