Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.55 |
| ▸ | RAB9A | P51151 | 3/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.55 |
| ▸ | TP53 | P04637 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | PKM | P14618 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | CA1 | P00915 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | BLM | P54132 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.49 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.49 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL8993223 | 0.85 | NPC1 (0.55) | NPC1RAB9ASMN1; SMN2MAPK1TP53 | |
| SCHEMBL28209856 | 0.85 | PARP1 (0.59) | MAPK1CA1CA2ROCK2ROCK1 | |
| SCHEMBL6343583 | 0.84 | SMN1; SMN2 (0.57) | NPC1RAB9ASMN1; SMN2MAPK1TP53 | |
| SCHEMBL2680771 | 0.82 | TSHR (0.64) | NPC1RAB9ASMN1; SMN2MAPK1TP53 | |
| SCHEMBL28345687 | 0.82 | SMN1; SMN2 (0.46) | NPC1RAB9ASMN1; SMN2MAPK1TP53 | |
| SCHEMBL10290007 | 0.80 | CASR (0.53) | ALDH1A1CA1CA2POLBCYP3A4 | |
| SCHEMBL12606656 | 0.80 | OPRD1 (0.63) | OPRD1CYP3A4 | |
| SCHEMBL10707052 | 0.79 | CASR (0.57) | AOC3L3MBTL1MTNR1AMTNR1B | |
| SCHEMBL16573862 | 0.79 | CA1 (0.66) | NPC1SMN1; SMN2MEN1ALDH1A1KMT2A | |
| SCHEMBL17024709 | 0.79 | CASR (0.74) | NPC1RAB9ASMN1; SMN2MAPK1TP53 |
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 |