Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.68 |
| ▸ | NPC1 | O15118 | 1/20 | 0.68 |
| ▸ | MAPT | P10636 | 1/20 | 0.68 |
| ▸ | RAB9A | P51151 | 1/20 | 0.68 |
| ▸ | LMNA | P02545 | 4/20 | 0.59 |
| ▸ | ESR1 | P03372 | 4/20 | 0.59 |
| ▸ | TSHR | P16473 | 3/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.59 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | STS | P08842 | 6/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.58 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.55 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL7721712 | 1.00 | ALDH1A1 (0.68) | ALDH1A1NPC1MAPTRAB9ALMNA | |
| SCHEMBL3041650 | 1.00 | ALDH1A1 (0.68) | ALDH1A1NPC1MAPTRAB9ALMNA | |
| SCHEMBL3906362 | 1.00 | ALDH1A1 (0.68) | ALDH1A1NPC1MAPTRAB9ALMNA | |
| SCHEMBL9097123 | 0.98 | ALDH1A1 (0.65) | ALDH1A1NPC1MAPTRAB9ALMNA | |
| SCHEMBL9099239 | 0.94 | ESR1 (0.68) | ALDH1A1NPC1MAPTRAB9ALMNA | |
| SCHEMBL8382842 | 0.92 | TDP1 (0.58) | ALDH1A1NPC1MAPTRAB9ALMNA | |
| SCHEMBL20464827 | 0.92 | MAPT (0.58) | ALDH1A1NPC1MAPTRAB9ALMNA | |
| SCHEMBL11856354 | 0.89 | ALDH1A1 (0.69) | ALDH1A1NPC1MAPTRAB9ALMNA | |
| SCHEMBL11866812 | 0.89 | ALDH1A1 (0.69) | ALDH1A1NPC1MAPTRAB9ALMNA | |
| SCHEMBL11856349 | 0.89 | ALDH1A1 (0.69) | ALDH1A1NPC1MAPTRAB9ALMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-5075487-A | Charge transfer compounds | FUJI XEROX CO., LTD. (JP) | 1991-12-24 | — | — | US | disclosed |
| US-5011757-A | Electrophotographic photoreceptor containing a fluorene derivative | FUJI XEROX CO., LTD. (JP) | 1991-04-30 | — | — | US | disclosed |
| EP-0153826-B1 | LIQUID-CRYSTALLINE SUBSTITUTED BIPHENYL ESTERS | Chisso Corporation (JP) | 1990-06-13 | — | — | EP | disclosed |
| US-4737313-A | OPITICALLY ACTIVE | CHISSO CORPORATION (JP) | 1988-04-12 | — | — | US | disclosed |
| EP-0153826-A2 | Liquid-crystalline substituted biphenyl esters | Chisso Corporation (JP) | 1985-09-04 | — | — | EP | disclosed |