Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.44 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9529562 | 0.81 | KDM4E (0.42) | HTTKDM4ENPC1RAB9AAGTR1 | |
| SCHEMBL9532029 | 0.81 | KDM4E (0.42) | ALDH1A1MAPTHPGDHTTCYP2C19 | |
| SCHEMBL10407326 | 0.80 | CYP2C19 (0.47) | ALDH1A1MAPTHPGDCYP2C19CYP3A4 | |
| SCHEMBL23366565 | 0.77 | KDM4E (0.49) | ALDH1A1MAPTHPGDHTTMAPK1 | |
| SCHEMBL9529668 | 0.77 | KDM4E (0.47) | ALDH1A1MAPTCYP2C19CYP3A4ADRA2A | |
| SCHEMBL9532053 | 0.76 | NPC1 (0.43) | ALDH1A1MAPTHPGDHTTCYP2C19 | |
| SCHEMBL9530012 | 0.76 | KDM4E (0.42) | ALDH1A1MAPTHTTCYP2C19CYP3A4 | |
| SCHEMBL9527768 | 0.75 | CYP2C9 (0.40) | ALDH1A1HPGDHTTADRA2AADRA2B | |
| SCHEMBL9529150 | 0.71 | CYP4F2 (0.41) | ALDH1A1MAPTHPGDHTTKDM4E | |
| SCHEMBL9532748 | 0.71 | POLB (0.46) | ALDH1A1HTTCYP2C19CYP3A4MAPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0366006-B1 | PYRIDYLKETOXIME ETHER COMPOUND AND PHARMACEUTICAL COMPOSITION CONTAINING IT | KAKEN PHARMACEUTICAL CO., LTD. (JP) | 1993-09-29 | — | — | EP | disclosed |
| US-4971985-A | ANTIISCHEMIC AGENTS, CARDIOVASCULAR DISORDERS | KAKEN PHARMACEUTICAL CO., LTD. (JP) | 1990-11-20 | — | — | US | disclosed |