Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8095627 | 0.83 | LTA4H (0.53) | LTA4HTAAR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL31426960 | 0.81 | ALDH1A1 (0.47) | KMT2ATAAR1MEN1SMN1; SMN2CYP1A2 | |
| SCHEMBL102904 | 0.81 | ALDH1A1 (0.47) | KMT2ATAAR1MEN1SMN1; SMN2CYP1A2 | |
| Water SCHEMBL28641184 | 0.81 | ALDH1A1 (0.47) | KMT2ATAAR1MEN1SMN1; SMN2CYP1A2 | |
| SCHEMBL27287538 | 0.79 | HTR2A (0.44) | KMT2ASLC6A2SLC6A4SLC6A3SMN1; SMN2 | |
| SCHEMBL4003141 | 0.79 | KEAP1 (0.63) | KMT2ATAAR1MEN1CYP3A4CYP2D6 | |
| SCHEMBL8992952 | 0.79 | NPC1 (0.50) | LTA4HTAAR1TSHRALDH1A1MAPT | |
| SCHEMBL8993391 | 0.78 | CNR2 (0.44) | KMT2AMEN1TSHRLMNAMAPT | |
| SCHEMBL6378299 | 0.77 | POLB (0.51) | LTA4HKMT2ATAAR1MEN1CYP3A4 | |
| SCHEMBL2140995 | 0.77 | CALM1 (0.57) | LTA4HKMT2ATAAR1MEN1SMN1; SMN2 |
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 |