Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.44 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 2/20 | 0.33 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10488442 | 0.92 | CYP1A2 (0.41) | KMT2ANPBWR1MCHR1CYP1A2CYP2A6 | |
| SCHEMBL10488406 | 0.88 | HTR2A (0.43) | KMT2ANPBWR1MCHR1CYP1A2SLC2A1 | |
| Hydrochloric Acid SCHEMBL10488372 | 0.86 | KMT2A (0.43) | KMT2ANPBWR1MCHR1CYP1A2SLC2A1 | |
| SCHEMBL10348808 | 0.85 | KMT2A (0.40) | KMT2ANPBWR1MCHR1CYP1A2SLC2A1 | |
| SCHEMBL10488585 | 0.83 | KMT2A (0.50) | KMT2ANPBWR1MCHR1CYP1A2CYP2A6 | |
| Hydrochloric Acid SCHEMBL10488318 | 0.82 | KMT2A (0.52) | KMT2ANPBWR1MCHR1CYP1A2CYP2A6 | |
| SCHEMBL10348864 | 0.80 | KMT2A (0.41) | KMT2ANPBWR1MCHR1CYP1A2CYP2A6 | |
| SCHEMBL10488510 | 0.80 | HTR2A (0.39) | KMT2ANPBWR1MCHR1CYP1A2SLC2A1 | |
| SCHEMBL10348690 | 0.80 | SLC2A1 (0.48) | KMT2ANPBWR1MCHR1SLC2A1HTR2A | |
| SCHEMBL1070224 | 0.79 | CYP1A2 (0.52) | CYP1A2CYP2A6HTR2AL3MBTL1CNR2 |
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 5 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-4803221-A | Anthracene derivatives | BURROUGHS WELLCOME CO. (US) | 1989-02-07 | — | — | US | disclosed |
| US-4719049-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 |