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SMILES: Cc1cnc([nH]1)-c1cc(ccn1)-c1cncc(c1)S(=O)(=O)N[C@H]1CC[C@](C)(O)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 2 hits for monomerid = 557245   
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
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM557245
PNG
(US11352340, Example 298)
Show SMILES Cc1cnc([nH]1)-c1cc(ccn1)-c1cncc(c1)S(=O)(=O)N[C@H]1CC[C@](C)(O)CC1 |r,wU:22.24,25.28,wD:25.29,(-.8,7.04,;-.03,5.7,;-.93,4.46,;-.03,3.21,;1.44,3.69,;1.44,5.23,;2.77,2.92,;2.77,1.38,;4.1,.61,;5.44,1.38,;5.44,2.92,;4.1,3.69,;4.1,-.93,;5.44,-1.7,;5.44,-3.24,;4.1,-4.01,;2.77,-3.24,;2.77,-1.7,;1.44,-4.01,;.67,-5.34,;2.21,-5.34,;.1,-3.24,;-1.23,-4.01,;-1.23,-5.55,;-2.56,-6.32,;-3.9,-5.55,;-5.44,-5.55,;-4.3,-7.04,;-3.9,-4.01,;-2.56,-3.24,)|
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<50n/an/an/an/an/an/a


TBA

Assay Description
The kinase reaction was conducted in polystyrene 384-well Greiner Bio-one white plate from Thermo Fisher Scientific in a final volume of 25 μL. ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q24T6NKW
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM557245
PNG
(US11352340, Example 298)
Show SMILES Cc1cnc([nH]1)-c1cc(ccn1)-c1cncc(c1)S(=O)(=O)N[C@H]1CC[C@](C)(O)CC1 |r,wU:22.24,25.28,wD:25.29,(-.8,7.04,;-.03,5.7,;-.93,4.46,;-.03,3.21,;1.44,3.69,;1.44,5.23,;2.77,2.92,;2.77,1.38,;4.1,.61,;5.44,1.38,;5.44,2.92,;4.1,3.69,;4.1,-.93,;5.44,-1.7,;5.44,-3.24,;4.1,-4.01,;2.77,-3.24,;2.77,-1.7,;1.44,-4.01,;.67,-5.34,;2.21,-5.34,;.1,-3.24,;-1.23,-4.01,;-1.23,-5.55,;-2.56,-6.32,;-3.9,-5.55,;-5.44,-5.55,;-4.3,-7.04,;-3.9,-4.01,;-2.56,-3.24,)|
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<50n/an/an/an/an/an/a


TBA

Assay Description
The kinase reaction was conducted in polystyrene 384-well Greiner Bio-one white plate from Thermo Fisher Scientific in a final volume of 25 μL. ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q24T6NKW
More data for this
Ligand-Target Pair