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SMILES: CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2NC(=O)O[C@@H](C)c12)c1ccc(Cl)cc1

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 = 50606329   
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
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (Human))
BDBM50606329
PNG
(CHEMBL5175332)
Show SMILES CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2NC(=O)O[C@@H](C)c12)c1ccc(Cl)cc1 |r|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.5n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00527
BindingDB Entry DOI: 10.7270/Q2TX3KGT
More data for this
Ligand-Target Pair
RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))
BDBM50606329
PNG
(CHEMBL5175332)
Show SMILES CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2NC(=O)O[C@@H](C)c12)c1ccc(Cl)cc1 |r|
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 0.200n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00527
BindingDB Entry DOI: 10.7270/Q2TX3KGT
More data for this
Ligand-Target Pair
RAC-beta serine/threonine-protein kinase


(Homo sapiens (Human))
BDBM50606329
PNG
(CHEMBL5175332)
Show SMILES CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2NC(=O)O[C@@H](C)c12)c1ccc(Cl)cc1 |r|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 11n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00527
BindingDB Entry DOI: 10.7270/Q2TX3KGT
More data for this
Ligand-Target Pair