Pictilisib

Pictilisib

SCHEMBL3045698

CS(=O)(=O)N1CCN(Cc2cc3nc(-c4cccc5[nH]ncc45)nc(N4CCOCC4)c3s2)CC1.C[BiH]S(=O)(=O)O

nearest known ligand 0.92

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5

The experimentally established mechanism targets of Pictilisib. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CA known ✓ P42336 16/20 0.90
PIK3CD known ✓ O00329 15/20 0.90
PIK3CB known ✓ P42338 14/20 0.90
PIK3CG known ✓ P48736 12/20 0.90
PIK3R2 known ✓ O00459 1/20 0.90
PIK3R1 known ✓ P27986 1/20 0.90
PIK3R5 known ✓ Q8WYR1 1/20 0.90
ABCC4 O15439 1/20 0.92
ABCB11 O95342 1/20 0.92
PIK3C2A O00443 1/20 0.90
PLK4 O00444 1/20 0.90
PIK3C2B O00750 1/20 0.90
GAK O14976 1/20 0.90
EPHB6 O15197 1/20 0.90
DAPK3 O43293 1/20 0.90
STK16 O75716 1/20 0.90
PIK3C2G O75747 1/20 0.90
NTRK1 P04629 1/20 0.90
NQO2 P16083 1/20 0.90
CSNK2A2 P19784 1/20 0.90

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Pictilisib SCHEMBL29370279 0.96 ABCC4 (1.00) ABCC4ABCB11PIK3CAPIK3CDPIK3CB
Pictilisib SCHEMBL29915227 0.96 ABCC4 (1.00) ABCC4ABCB11PIK3CAPIK3CDPIK3CB
Pictilisib SCHEMBL29387739 0.95 PIK3CA (1.00) ABCC4ABCB11PIK3CAPIK3CDPIK3CB
Pictilisib SCHEMBL29375636 0.95 PIK3CA (1.00) ABCC4ABCB11PIK3CAPIK3CDPIK3CB
Pictilisib SCHEMBL14859338 0.95 PIK3CA (1.00) ABCC4ABCB11PIK3CAPIK3CDPIK3CB
Pictilisib SCHEMBL190812 0.95 PIK3CA (1.00) ABCC4ABCB11PIK3CAPIK3CDPIK3CB
SCHEMBL190513 0.93 PIK3CA (0.95) ABCC4ABCB11PIK3CAPIK3CDPIK3CB
Pictilisib SCHEMBL31237882 0.91 PIK3CA (0.89) ABCC4ABCB11PIK3CAPIK3CDPIK3CB
SCHEMBL31205 0.89 PIK3CA (0.88) ABCC4ABCB11PIK3CAPIK3CDPIK3CB
SCHEMBL190211 0.88 PIK3CA (0.87) ABCC4ABCB11PIK3CAPIK3CDPIK3CB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2024372-B1 THIENO[3,2-D]PYRIMIDINE DERIVATIVE USEFUL AS PI3K INHIBITOR HOFFMANN LA ROCHE (CH) 2010-06-23 EP claimed