Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.37 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.37 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 5/20 | 0.36 |
| ▸ | NPC1 | O15118 | 4/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL991392 | 0.86 | NOTUM (0.50) | MEN1KMT2ALMNANOTUMRAB9A | |
| SCHEMBL988982 | 0.85 | NOTUM (0.39) | ALDH1A1MEN1KMT2AGAALMNA | |
| SCHEMBL988065 | 0.81 | THRB (0.42) | ALDH1A1MEN1KMT2AGAACYP3A4 | |
| SCHEMBL989371 | 0.81 | KDM4E (0.41) | ALDH1A1MEN1KMT2AGAACYP1A2 | |
| SCHEMBL4055690 | 0.80 | LMNA (0.36) | ALDH1A1MEN1KMT2AGAALMNA | |
| SCHEMBL1619624 | 0.78 | MAP3K14 (0.50) | PIK3CDPIK3R1MAP3K14 | |
| SCHEMBL988878 | 0.75 | NOTUM (0.55) | ALDH1A1MEN1KMT2AGAACYP1A2 | |
| SCHEMBL1516838 | 0.75 | SRD5A1 (0.38) | ALDH1A1GAALMNANOTUMMAOB | |
| SCHEMBL989368 | 0.72 | ALDH1A1 (0.38) | ALDH1A1MEN1KMT2AGAACYP3A4 | |
| SCHEMBL988463 | 0.69 | NOTUM (0.70) | ALDH1A1GAANOTUMMAP3K14KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2276767-A1 | BENZOPYRAN AND BENZOXEPIN PI3K INHIBITOR COMPOUNDS AND METHODS OF USE | Genentech, Inc. (US) | 2011-01-26 | — | — | EP | disclosed |
| WO-2009123971-A1 | BENZOPYRAN AND BENZOXEPIN PI3K INHIBITOR COMPOUNDS AND METHODS OF USE | GENENTECH, INC. (US) | 2009-10-08 | — | — | WO | disclosed |