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SMILES: Cn1cc(cn1)-c1ncc(C#N)c(n1)N1C[C@@H]2C[C@H]1CN2C(=O)C(C)(C)CF

InChI Key:

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 534827   
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))		BDBM534827
PNG
(4-[(1S,4R)-5-(3-fluoro-2,2- dimethylpropanoyl)-2,5...)
Show SMILES Cn1cc(cn1)-c1ncc(C#N)c(n1)N1C[C@@H]2C[C@H]1CN2C(=O)C(C)(C)CF |r,THB:21:20:17:15.14,12:14:17:19.20|
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/a 160n/an/an/an/an/an/a


TBA

Assay Description
This assay was developed and further optimized from a kit produced by Upstate (Millipore catalog #33-047) (Millipore Sigma, Billerica Mass., USA) and...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K35XTR
More data for this
Ligand-Target Pair