Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA3 | P22001 | 1/20 | 0.54 |
| ▸ | RECQL | P46063 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1835409 | 0.79 | KCNA3 (0.54) | KCNA3RECQLALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL17064289 | 0.79 | CYP1A2 (0.58) | KCNA3RECQLALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL19890286 | 0.79 | KCNA3 (0.54) | KCNA3RECQLALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL3293084 | 0.79 | KCNA3 (0.54) | KCNA3RECQLALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL6029021 | 0.78 | ALOX15 (0.56) | KCNA3RECQLALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL2357301 | 0.78 | KCNA3 (0.52) | KCNA3RECQLALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL1355547 | 0.77 | CYP1A2 (0.51) | KCNA3RECQLALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL44088 | 0.76 | CYP1A2 (0.54) | KCNA3RECQLALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL183053 | 0.75 | CYP1A2 (0.49) | KCNA3RECQLALDH1A1CYP1A2CYP3A4 | |
| Ethylene SCHEMBL29058163 | 0.74 | KCNA3 (0.74) | KCNA3RECQLALDH1A1TAAR1PKM |
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-0034784-B1 | 3,4,5-TRIHYDROXYPIPERIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION, THEIR USE AS MEDICINES AND IN ANIMAL FEEDING | BAYER AG (DE) | 1984-07-25 | — | — | EP | disclosed |
| EP-0034784-A1 | 3,4,5-trihydroxypiperidine derivatives, process for their preparation, their use as medicines and in animal feeding | BAYER AG (DE) | 1981-09-02 | — | — | EP | disclosed |