Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.62 |
| ▸ | TSHR | P16473 | 2/20 | 0.58 |
| ▸ | RAB9A | P51151 | 2/20 | 0.58 |
| ▸ | NPC1 | O15118 | 1/20 | 0.58 |
| ▸ | ATM | Q13315 | 1/20 | 0.58 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | HTR1A | P08908 | 1/20 | 0.52 |
| ▸ | DRD2 | P14416 | 1/20 | 0.52 |
| ▸ | HTR7 | P34969 | 1/20 | 0.52 |
| ▸ | HTR6 | P50406 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL5512457 | 0.78 | CYP2D6 (0.68) | CYP2D6CYP2C9CYP2C19TSHRRAB9A | |
| SCHEMBL2595618 | 0.78 | ALDH1A1 (0.55) | HTTALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL7211477 | 0.77 | CYP2D6 (0.66) | CYP2D6CYP2C9CYP2C19TSHRRAB9A | |
| SCHEMBL2229037 | 0.77 | CYP2D6 (0.51) | CYP2D6CYP2C9CYP2C19NPC1HTT | |
| SCHEMBL7217749 | 0.74 | CYP2D6 (0.72) | CYP2D6CYP2C9CYP2C19TSHRHTT | |
| SCHEMBL28588864 | 0.74 | CYP2D6 (0.72) | CYP2D6CYP2C9CYP2C19TSHRRAB9A | |
| SCHEMBL5655445 | 0.74 | CYP2D6 (0.72) | CYP2D6CYP2C9CYP2C19TSHRRAB9A | |
| SCHEMBL6394573 | 0.74 | TSHR (0.76) | CYP2D6CYP2C9CYP2C19TSHRRAB9A | |
| SCHEMBL12465590 | 0.73 | TSHR (0.68) | CYP2D6CYP2C9CYP2C19TSHRRAB9A | |
| SCHEMBL6127693 | 0.73 | CYP2D6 (0.82) | CYP2D6CYP2C9CYP2C19TSHRRAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1239852-A2 | BISSULFONAMIDE DERIVATIVES AS ENZYME INHIBITORS | Arrow Therapeutics Limited (GB) | 2002-09-18 | — | — | EP | disclosed |
| WO-2001028537-A2 | BISSULFONAMIDE DERIVATIVES AS ENZYME INHIBITORS | ARROW THERAPEUTICS LIMITED (GB) | 2001-04-26 | — | — | WO | disclosed |