SCHEMBL3131698

SCHEMBL3131698

[CH2]c1ncnc2c1c(-c1cccc(N)c1)cn2C(C)C

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 1/20 0.61
▸ PIK3CA P42336 1/20 0.61
▸ PIK3CB P42338 1/20 0.61
▸ PIK3CG P48736 1/20 0.61
▸ PRKDC P78527 1/20 0.61
▸ KDR P35968 12/20 0.48
▸ TEK Q02763 9/20 0.48
▸ LCK P06239 6/20 0.48
▸ SRC P12931 3/20 0.48
▸ RET P07949 4/20 0.44
▸ ABL1 P00519 3/20 0.42
▸ EGFR P00533 3/20 0.42
▸ ABL2 P42684 3/20 0.42

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
SCHEMBL409453 0.83 PIK3CD (0.58) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL440644 0.83 PIK3CD (0.58) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL407936 0.76 PIK3CD (1.00) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL7057974 0.73 PIK3CD (0.73) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL7007567 0.71 KDR (0.71) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL7009436 0.69 KDR (0.55) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL409452 0.69 PIK3CD (0.71) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL7058330 0.68 PIK3CD (0.55) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL2074398 0.67 PIK3CD (0.73) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL13020100 0.67 KDR (0.68) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC

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
WO-2010059593-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF OPHTHALMIC CONDITIONS INTELLIKINE, INC. (US) 2010-05-27 — — WO disclosed
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