Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 1/20 | 0.46 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | LTA4H | P09960 | 3/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8992998 | 0.85 | NPC1 (0.54) | MTNR1AMTNR1BTAAR1NPC1RAB9A | |
| Ethylene SCHEMBL8993055 | 0.84 | MEN1 (0.42) | TAAR1LTA4HCHRM2CHRM1CHRM3 | |
| Anisaldehyde SCHEMBL12503524 | 0.78 | ALDH1A1 (0.66) | NPC1RAB9ATDP1ALDH1A1CYP2A6 | |
| Anisaldehyde SCHEMBL9139931 | 0.78 | ALDH1A1 (0.66) | NPC1RAB9ATDP1ALDH1A1CYP2A6 | |
| Ethylene SCHEMBL6226363 | 0.78 | LMNA (0.48) | ALDH1A1CYP2A6LMNAMAPT | |
| SCHEMBL27514736 | 0.77 | NPC1 (0.57) | MTNR1AMTNR1BTAAR1NPC1RAB9A | |
| Ethylene SCHEMBL10689209 | 0.74 | ALDH1A1 (0.40) | RAB9AALDH1A1CYP2A6LMNAMAPT | |
| Benzaldehyde SCHEMBL11346796 | 0.74 | ALDH1A1 (0.50) | NPC1ALDH1A1CYP2A6LMNAMEN1 | |
| SCHEMBL11066566 | 0.73 | TBXAS1 (0.52) | TDP1ALDH1A1TP53 | |
| SCHEMBL18635836 | 0.73 | HDAC1 (0.68) | NPC1RAB9ATDP1HDAC3HDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5516777-A | PROSTATE CANCER THERAPY | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1996-05-14 | — | — | US | disclosed |
| US-5409928-A | Prostate diseases, alopecia | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1995-04-25 | — | — | US | disclosed |
| EP-0594149-A2 | Condensed pyrazole derivatives, method of manufacturing the same, and androgen inhibitor | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1994-04-27 | — | — | EP | disclosed |