BDBM50537721 CHEMBL4646478
SMILES: [H][C@]12CN(c3nc(ncc3C#N)-c3ccnc4[nH]ccc34)[C@]([H])(CN1c1cccc(F)c1)C2
InChI Key: InChIKey=CUUSXHFSMFZOJP-ROUUACIJSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50537721 Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Phosphoinositide 3-Kinase (PI3K), delta
(Homo sapiens (Human)) | BDBM50537721
(CHEMBL4646478)Show SMILES [H][C@]12CN(c3nc(ncc3C#N)-c3ccnc4[nH]ccc34)[C@]([H])(CN1c1cccc(F)c1)C2 |r| Show InChI InChI=1S/C23H18FN7/c24-15-2-1-3-16(8-15)30-12-18-9-17(30)13-31(18)23-14(10-25)11-28-22(29-23)20-5-7-27-21-19(20)4-6-26-21/h1-8,11,17-18H,9,12-13H2,(H,26,27)/t17-,18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 56 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck & Co.
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human full-length N-terminal GST-tagged p110delta/untagged full-length p85alpha expressed in baculovirus infected Sf21 cell... |
Bioorg Med Chem Lett 30: (2020)
|
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50537721
(CHEMBL4646478)Show SMILES [H][C@]12CN(c3nc(ncc3C#N)-c3ccnc4[nH]ccc34)[C@]([H])(CN1c1cccc(F)c1)C2 |r| Show InChI InChI=1S/C23H18FN7/c24-15-2-1-3-16(8-15)30-12-18-9-17(30)13-31(18)23-14(10-25)11-28-22(29-23)20-5-7-27-21-19(20)4-6-26-21/h1-8,11,17-18H,9,12-13H2,(H,26,27)/t17-,18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck & Co.
Curated by ChEMBL
| Assay Description
Inhibition of the fibroblast growth factor receptor (FGFR1) |
Bioorg Med Chem Lett 30: (2020)
|
More data for this
Ligand-Target Pair | |
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