Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTOR | P42345 | 5/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.35 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.35 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.35 |
| ▸ | USP2 | O75604 | 5/20 | 0.35 |
| ▸ | CASP7 | P55210 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | CASP1 | P29466 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.33 |
| ▸ | HBB | P68871 | 1/20 | 0.33 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL22200424 | 0.86 | MTOR (0.37) | MTOREGFRFGFR1SRCFGFR2 | |
| SCHEMBL22200350 | 0.85 | USP2 (0.38) | MTOREGFRFGFR1SRCFGFR2 | |
| SCHEMBL22200363 | 0.84 | EGFR (0.46) | MTOREGFRFGFR1SRCFGFR2 | |
| SCHEMBL25035544 | 0.82 | MTOR (0.42) | MTORCYP1A2USP2CASP7ALDH1A1 | |
| SCHEMBL22200634 | 0.81 | MTOR (0.41) | MTORCYP1A2USP2CASP7ALDH1A1 | |
| SCHEMBL22200787 | 0.79 | MTOR (0.40) | MTORCYP1A2USP2CASP7ALDH1A1 | |
| SCHEMBL22200437 | 0.77 | MTOR (0.52) | MTORCYP1A2USP2CASP7ALDH1A1 | |
| SCHEMBL22200817 | 0.77 | MTOR (0.40) | MTORCYP1A2USP2CASP7ALDH1A1 | |
| SCHEMBL22200653 | 0.77 | MTOR (0.38) | MTORALDH1A1HSD17B10PIK3CAHPGD | |
| SCHEMBL25035488 | 0.76 | ALDH1A1 (0.44) | MTORCYP1A2USP2CASP7ALDH1A1 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020142612-A1 | PYRIDO-PYRIMIDINONE AND PTERIDINONE COMPOUNDS AS INHIBITORS OF ENDORIBONUCLEASE INOSITOL REQUIRING ENZYME I (IRE I ALPHA) FOR THE TREATMENT OF CANCER DISEASES. | GENENTECH, INC. (US) | 2020-07-09 | — | — | WO | disclosed |