Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSMB8 | P28062 | 2/20 | 0.53 |
| ▸ | PKM | P14618 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | METAP1 | P53582 | 2/20 | 0.45 |
| ▸ | METAP2 | P50579 | 1/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | AURKA | O14965 | 1/20 | 0.43 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.42 |
| ▸ | CHUK | O15111 | 1/20 | 0.41 |
| ▸ | PDE5A | O76074 | 2/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | HPSE | Q9Y251 | 1/20 | 0.40 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14427087 | 0.85 | PSMB8 (0.49) | PSMB8CHUKPKN1PKN2KDM5A | |
| SCHEMBL3147724 | 0.81 | ALDH1A1 (0.46) | PKMALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL244929 | 0.75 | PSMB8 (0.58) | PSMB8PKMALDH1A1NPC1RAB9A | |
| SCHEMBL31677104 | 0.75 | PSMB8 (0.58) | PSMB8PKMALDH1A1NPC1RAB9A | |
| SCHEMBL1170780 | 0.74 | ALDH1A1 (0.68) | PKMALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL30434444 | 0.74 | KRAS (0.48) | PKMALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL29016996 | 0.74 | KRAS (0.48) | PKMALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5453996 | 0.74 | ALDH1A1 (0.66) | PKMALDH1A1NPC1RAB9ASMN1; SMN2 | |
| Lithium SCHEMBL15812806 | 0.73 | PSMB8 (0.56) | PSMB8PKMALDH1A1NPC1RAB9A | |
| SCHEMBL30494300 | 0.71 | CYP11B1 (0.55) | PSMB8 |
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-1739081-A1 | HYDRAZINO-SUBSTITUTED HETEROCYCLIC NITRILE COMPOUNDS AND USE THEREOF | ONO PHARMACEUTICAL CO., LTD. (JP) | 2007-01-03 | — | — | EP | disclosed |