Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DDB1 | Q16531 | 1/20 | 0.33 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.31 |
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 3/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.30 |
| ▸ | MEN1 | O00255 | 2/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5963643 | 0.86 | KMT2A (0.36) | KDM4EALDH1A1HSD17B10PARP1MAPT | |
| SCHEMBL4179962 | 0.77 | — | — | |
| SCHEMBL4179958 | 0.77 | — | — | |
| SCHEMBL4182821 | 0.72 | — | — | |
| SCHEMBL4185620 | 0.72 | KMT2A (0.43) | ALDH1A1MAPTMEN1KMT2ARAB9A | |
| SCHEMBL4185609 | 0.72 | KMT2A (0.43) | ALDH1A1MAPTMEN1KMT2ARAB9A | |
| SCHEMBL4182829 | 0.72 | — | — | |
| SCHEMBL4185613 | 0.72 | KMT2A (0.43) | ALDH1A1MAPTMEN1KMT2ARAB9A | |
| SCHEMBL4182823 | 0.72 | — | — | |
| SCHEMBL4178546 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0896577-B1 | Taxane derivatives having a Pyridyl substituted C13 side chain and their use as anti-tumor agents | SCHERING AG (DE) | 2003-03-05 | — | — | EP | disclosed |
| US-6162920-A | Taxane derivatives having a pyridyl substituted C13 side chain, their preparation and their use as anti-tumor agents | SCHERING AKTIENSGESELLSCHAFT (DE) | 2000-12-19 | — | — | US | disclosed |
| EP-0896577-A1 | TAXANE DERIVATIVES HAVING A PYRIDIL SUBSTITUTED C13 SIDE CHAIN, THEIR PREPARATION AND THEIR USE AS ANTI-TUMOR AGENTS | SCHERING AKTIENGESELLSCHAFT (DE) | 1999-02-17 | — | — | EP | disclosed |
| WO-1997028156-A1 | TAXANE DERIVATIVES HAVING A PYRIDYL SUBSTITUTED C13 SIDE CHAIN, THEIR PREPARATION AND THEIR USE AS ANTI-TUMOR AGENTS | SCHERING AKTIENGESELLSCHAFT PATENTE (DE) | 1997-08-07 | — | — | WO | disclosed |