Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.41 |
| ▸ | RAB9A | P51151 | 5/20 | 0.41 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
| ▸ | MMP8 | P22894 | 1/20 | 0.39 |
| ▸ | MMP13 | P45452 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CASP3 | P42574 | 1/20 | 0.38 |
| ▸ | DAGLA | Q9Y4D2 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.35 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Iodide SCHEMBL7305936 | 0.99 | NPC1 (0.40) | NPC1RAB9AMAPTSMN1; SMN2KMT2A | |
| Bromide SCHEMBL6488179 | 0.83 | KDM4E (0.41) | NPC1RAB9AMAPTSMN1; SMN2KMT2A | |
| Iodide SCHEMBL7306788 | 0.81 | ESR1 (0.36) | NPC1RAB9AKMT2AGAA | |
| Iodide SCHEMBL7305544 | 0.79 | GABRP (0.44) | KMT2AALDH1A1L3MBTL1GAA | |
| SCHEMBL31349462 | 0.79 | NPC1 (0.53) | NPC1RAB9AMAPTSMN1; SMN2KMT2A | |
| Iodide SCHEMBL7307306 | 0.78 | SORD (0.47) | MAPTSMN1; SMN2KMT2ALMNAGAA | |
| Hydrochloric Acid SCHEMBL7305474 | 0.78 | SORD (0.47) | MAPTSMN1; SMN2KMT2ALMNAGAA | |
| SCHEMBL6488937 | 0.78 | APP (0.50) | NPC1RAB9AMAPTSMN1; SMN2KMT2A | |
| Iodide SCHEMBL7307948 | 0.78 | PRKDC (0.38) | KMT2AGAA | |
| SCHEMBL31349474 | 0.78 | GAA (0.52) | NPC1RAB9AMAPTSMN1; SMN2KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0621271-B1 | Benzoxazole derivatives and their use as serotonin 5-HT3 receptor antagonists | MEIJI SEIKA KAISHA (JP) | 2001-10-17 | — | — | EP | disclosed |