Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 5/20 | 0.38 |
| ▸ | SLC1A3 | P43003 | 4/20 | 0.36 |
| ▸ | SLC1A2 | P43004 | 4/20 | 0.36 |
| ▸ | SLC1A1 | P43005 | 4/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | MYC | P01106 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7325808 | 1.00 | KIF11 (0.38) | KIF11SLC1A3SLC1A2SLC1A1PDK2 | |
| SCHEMBL7315293 | 0.86 | KIF11 (0.40) | KIF11SLC1A3SLC1A2SLC1A1PDK2 | |
| SCHEMBL7315297 | 0.86 | KIF11 (0.40) | KIF11SLC1A3SLC1A2SLC1A1PDK2 | |
| SCHEMBL7317362 | 0.86 | KIF11 (0.44) | KIF11SLC1A3SLC1A2SLC1A1PDK2 | |
| SCHEMBL7317367 | 0.86 | KIF11 (0.44) | KIF11SLC1A3SLC1A2SLC1A1PDK2 | |
| SCHEMBL7323867 | 0.86 | KIF11 (0.44) | KIF11SLC1A3SLC1A2SLC1A1PDK2 | |
| SCHEMBL7320576 | 0.85 | KIF11 (0.38) | KIF11SLC1A3SLC1A2SLC1A1PDK2 | |
| SCHEMBL7320568 | 0.85 | KIF11 (0.38) | KIF11SLC1A3SLC1A2SLC1A1PDK2 | |
| SCHEMBL7323246 | 0.84 | KIF11 (0.38) | KIF11SLC1A3SLC1A2SLC1A1PDK2 | |
| SCHEMBL7325936 | 0.84 | KMT2A (0.41) | KIF11SLC1A3SLC1A2SLC1A1PDK2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1999041227-A1 | TRICYCLIC COMPOUNDS AS GLYCINE TRANSPORT INHIBITORS | ALLELIX NEUROSCIENCE, INC. (US) | 1999-08-19 | — | — | WO | claimed |
| US-6162824-A | NERVOUS SYSTEM DISORDERS; PSYCHOLOGICAL DISORDERS | ALLELIX NEUROSCIENCE INC. | 2000-12-19 | — | — | US | disclosed |
| WO-1999041227-A1 | TRICYCLIC COMPOUNDS AS GLYCINE TRANSPORT INHIBITORS | ALLELIX NEUROSCIENCE, INC. (US) | 1999-08-19 | — | — | WO | disclosed |