Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 16/20 | 1.00 |
| ▸ | SRC | P12931 | 12/20 | 0.64 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1388782 | 0.82 | EGFR (1.00) | EGFRSRCNPC1ALDH1A1FGFR1 | |
| SCHEMBL1388406 | 0.77 | EGFR (1.00) | EGFRSRCALDH1A1MAPTMEN1 | |
| SCHEMBL1388357 | 0.77 | EGFR (1.00) | EGFRSRCNPC1ALDH1A1MAPT | |
| SCHEMBL8743594 | 0.74 | ALDH1A1 (0.70) | EGFRSRCNPC1ALDH1A1MAPT | |
| SCHEMBL23411574 | 0.73 | EGFR (0.61) | EGFRSRCNPC1ALDH1A1MAPT | |
| SCHEMBL29891635 | 0.73 | EGFR (0.61) | EGFRSRCNPC1ALDH1A1MAPT | |
| SCHEMBL8568557 | 0.71 | TSHR (0.60) | EGFRSRCNPC1ALDH1A1MAPT | |
| SCHEMBL369887 | 0.71 | EGFR (0.55) | EGFRSRCNPC1ALDH1A1FGFR1 | |
| SCHEMBL7850488 | 0.67 | RAB9A (0.56) | EGFRSRCNPC1ALDH1A1MAPT | |
| SCHEMBL6671401 | 0.67 | EGFR (0.66) | EGFRSRCALDH1A1MAPTMEN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-H08503450-A | — | — | 1996-04-16 | — | — | JP | claimed |
| US-5464861-A | Anticarcinogenic agents | WARNER-LAMBERT (US) | 1995-11-07 | — | — | US | claimed |
| EP-0654024-A1 | 2-THIOINDOLES (SELENOINDOLES) AND RELATED DISULFIDES (SELENIDES) WHICH INHIBIT PROTEIN TYROSINE KINASES AND WHICH HAVE ANTITUMOR PROPERTIES | WARNER-LAMBERT COMPANY (US) | 1995-05-24 | — | — | EP | claimed |
| WO-1994003427-A1 | 2-THIOINDOLES (SELENOINDOLES) AND RELATED DISULFIDES (SELENIDES) WHICH INHIBIT PROTEIN TYROSINE KINASES AND WHICH HAVE ANTITUMOR PROPERTIES | WARNER-LAMBERT COMPANY (US) | 1994-02-17 | — | — | WO | claimed |