Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC2A1 | P11166 | 1/20 | 0.46 |
| ▸ | HPRT1 | P00492 | 5/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.32 |
| ▸ | LCK | P06239 | 1/20 | 0.32 |
| ▸ | FYN | P06241 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | AHR | P35869 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Crisnatol SCHEMBL15990 | 0.92 | SLC2A1 (0.52) | SLC2A1HPRT1ALDH1A1NPBWR1KMT2A | |
| Crisnatol SCHEMBL6257042 | 0.92 | SLC2A1 (0.52) | SLC2A1HPRT1ALDH1A1NPBWR1KMT2A | |
| Crisnatol SCHEMBL10484286 | 0.91 | SLC2A1 (0.51) | SLC2A1HPRT1ALDH1A1NPBWR1KMT2A | |
| SCHEMBL10546000 | 0.91 | SLC2A1 (0.48) | SLC2A1ALDH1A1KDM4ENPBWR1KMT2A | |
| Crisnatol SCHEMBL3883 | 0.86 | SLC2A1 (0.61) | SLC2A1HPRT1ALDH1A1MAPTHPGD | |
| SCHEMBL10484175 | 0.85 | SLC2A1 (0.44) | SLC2A1HPRT1ALDH1A1NPBWR1KMT2A | |
| SCHEMBL10649536 | 0.85 | SLC2A1 (0.57) | SLC2A1ALDH1A1KDM4EHPGDCYP1A2 | |
| SCHEMBL10649048 | 0.85 | SLC2A1 (0.57) | SLC2A1ALDH1A1KDM4EHPGDCYP1A2 | |
| Hydrochloric Acid SCHEMBL10484306 | 0.84 | SLC2A1 (0.43) | SLC2A1HPRT1ALDH1A1NPBWR1KMT2A | |
| SCHEMBL10484297 | 0.84 | NPBWR1 (0.45) | SLC2A1HPRT1ALDH1A1NPBWR1KMT2A |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0125702-B1 | POLYCYCLIC AROMATIC COMPOUNDS | THE WELLCOME FOUNDATION LIMITED (GB) | 1987-08-12 | — | — | EP | claimed |
| US-4829090-A | SECONDARY AMINES, ANTITUMOR | BURROUGHS WELLCOME CO. (US) | 1989-05-09 | — | — | US | disclosed |
| US-4810727-A | ANTITUMOR | BURROUGHS WELLCOME CO. (US) | 1989-03-07 | — | — | US | disclosed |
| US-4719048-A | ANTITUMOR | BURROUGHS WELLCOME CO. (US) | 1988-01-12 | — | — | US | disclosed |
| US-4719046-A | ANTITUMOR | BURROUGHS WELLCOME CO. (US) | 1988-01-12 | — | — | US | disclosed |
| EP-0125702-B1 | POLYCYCLIC AROMATIC COMPOUNDS | THE WELLCOME FOUNDATION LIMITED (GB) | 1987-08-12 | — | — | EP | disclosed |
| EP-0125702-A2 | Polycyclic aromatic compounds | THE WELLCOME FOUNDATION LIMITED (GB) | 1984-11-21 | — | — | EP | disclosed |