Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.50 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | KDM4C | Q9H3R0 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | KDM5A | P29375 | 2/20 | 0.46 |
| ▸ | KDM5B | Q9UGL1 | 2/20 | 0.46 |
| ▸ | KDM6B | O15054 | 2/20 | 0.46 |
| ▸ | KDM5C | P41229 | 2/20 | 0.46 |
| ▸ | KDM2A | Q9Y2K7 | 2/20 | 0.46 |
| ▸ | KDM3A | Q9Y4C1 | 2/20 | 0.46 |
| ▸ | TET3 | O43151 | 1/20 | 0.46 |
| ▸ | KDM4A | O75164 | 1/20 | 0.46 |
| ▸ | BBOX1 | O75936 | 1/20 | 0.46 |
| ▸ | ASPH | Q12797 | 1/20 | 0.46 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4641324 | 0.86 | TDP1 (0.50) | TDP1DYRK1ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL487232 | 0.81 | KDM4E (0.47) | TDP1DYRK1ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL2810092 | 0.81 | LMNA (0.50) | TDP1DYRK1ANPC1RAB9AKDM4E | |
| SCHEMBL1732368 | 0.79 | SMYD3 (0.49) | TDP1DYRK1AKDM4EKDM4CALDH1A1 | |
| SCHEMBL437621 | 0.79 | NR4A2 (0.54) | TDP1DYRK1AKDM4EKDM4CALDH1A1 | |
| SCHEMBL31175317 | 0.76 | CYP1A2 (0.55) | TDP1NPC1RAB9ASMN1; SMN2KDM4E | |
| SCHEMBL21816246 | 0.76 | CYP1A2 (0.55) | TDP1NPC1RAB9ASMN1; SMN2KDM4E | |
| SCHEMBL16447569 | 0.76 | TDP1 (0.54) | TDP1DYRK1ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL21218143 | 0.75 | MET (0.58) | KDM4EALDH1A1MAPTHPGDGAA | |
| SCHEMBL13544381 | 0.75 | TDP1 (0.49) | TDP1NPC1RAB9ASMN1; SMN2KDM4E |
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-1140944-B1 | EPOTHILONE DERIVATIVES AND THEIR USE AS ANTITUMOR AGENTS | NOVARTIS AG (CH) | 2003-08-27 | — | — | EP | disclosed |
| US-6387927-B1 | WATER SOLUBILITY | NOVATIS AG (CH) | 2002-05-14 | — | — | US | disclosed |
| EP-1140944-A1 | EPOTHILONE DERIVATIVES AND THEIR USE AS ANTITUMOR AGENTS | Novartis AG (CH) | 2001-10-10 | — | — | EP | disclosed |
| WO-2000037473-A1 | EPOTHILONE DERIVATIVES AND THEIR USE AS ANTITUMOR AGENTS | NOVARTIS AG (CH) | 2000-06-29 | — | — | WO | disclosed |