Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC2A1 | P11166 | 1/20 | 0.42 |
| ▸ | CD274 | Q9NZQ7 | 6/20 | 0.36 |
| ▸ | PDCD1 | Q15116 | 4/20 | 0.35 |
| ▸ | PDCD1LG2 | Q9BQ51 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | MC5R | P33032 | 1/20 | 0.33 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10488341 | 0.94 | SLC2A1 (0.50) | SLC2A1CD274PDCD1CYP1A2CYP3A4 | |
| SCHEMBL10488864 | 0.85 | SLC2A1 (0.46) | SLC2A1CD274PDCD1MAPTKMT2A | |
| SCHEMBL10488906 | 0.84 | SLC2A1 (0.42) | SLC2A1CD274PDCD1MAPTKMT2A | |
| Hydrochloric Acid SCHEMBL10488204 | 0.83 | SLC2A1 (0.45) | SLC2A1CD274PDCD1MAPTKMT2A | |
| Hydrochloric Acid SCHEMBL10488254 | 0.83 | SLC2A1 (0.41) | SLC2A1CD274PDCD1MAPTKMT2A | |
| SCHEMBL10803667 | 0.80 | NPBWR1 (0.35) | SLC2A1CD274KMT2ANPBWR1MCHR1 | |
| SCHEMBL10349041 | 0.80 | NPBWR1 (0.38) | SLC2A1CD274CYP1A2KMT2ANPBWR1 | |
| SCHEMBL11091727 | 0.80 | KMT2A (0.34) | CD274PDCD1LG2CYP1A2CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL10349542 | 0.79 | NPBWR1 (0.40) | SLC2A1CD274CYP1A2KMT2ANPBWR1 | |
| SCHEMBL9466408 | 0.78 | SLC2A1 (0.38) | SLC2A1CD274PDCD1CYP3A4CYP2C19 |
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-0125702-B1 | POLYCYCLIC AROMATIC COMPOUNDS | THE WELLCOME FOUNDATION LIMITED (GB) | 1987-08-12 | — | — | EP | claimed |
| EP-0125702-A2 | Polycyclic aromatic compounds | THE WELLCOME FOUNDATION LIMITED (GB) | 1984-11-21 | — | — | EP | claimed |
| US-4719049-A | ANTITUMOR | BURROUGHS WELLCOME CO. (US) | 1988-01-12 | — | — | US | disclosed |
| EP-0125702-A2 | Polycyclic aromatic compounds | THE WELLCOME FOUNDATION LIMITED (GB) | 1984-11-21 | — | — | EP | disclosed |