Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.41 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | COMT | P21964 | 1/20 | 0.40 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.40 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.40 |
| ▸ | CHKA | P35790 | 1/20 | 0.40 |
| ▸ | EP300 | Q09472 | 1/20 | 0.39 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.39 |
| ▸ | KAT2A | Q92830 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28958218 | 0.84 | POLB (0.56) | ALDH1A1HDAC1NPC1CHRNA1CHRNA7 | |
| SCHEMBL9742340 | 0.82 | KDM4E (0.54) | ALDH1A1KDM4E | |
| SCHEMBL9514131 | 0.82 | ALDH1A1 (0.60) | ALDH1A1KDM4ENPC1CHRNA1CHRNA7 | |
| SCHEMBL28958322 | 0.79 | ALDH1A1 (0.50) | ALDH1A1KDM4EHDAC1NPC1CHRNA1 | |
| SCHEMBL9511632 | 0.79 | HTT (0.59) | ALDH1A1KDM4EHTTPOLB | |
| SCHEMBL4182979 | 0.78 | MAPK1 (0.57) | ALDH1A1KDM4EL3MBTL1POLB | |
| SCHEMBL9743824 | 0.75 | ALDH1A1 (0.44) | ALDH1A1NPC1CHRNA1CHRNA7HIF1A | |
| SCHEMBL9511103 | 0.74 | KDM4E (0.57) | ALDH1A1KDM4EHDAC1POLB | |
| SCHEMBL23310507 | 0.73 | L3MBTL1 (0.59) | ALDH1A1KDM4EHDAC1L3MBTL1CHKA | |
| SCHEMBL9742351 | 0.73 | KMT2A (0.50) | ALDH1A1KDM4ECOMTSIRT2SIRT1 |
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-5169859-A | Antisecretory or antiulcer agents | RICHTER GEDEON VEGYESZETI GYAR RT (HU) | 1992-12-08 | — | — | US | disclosed |
| EP-0455774-A1 | THIAZOLIDINONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR PREPARING SAME | RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) | 1991-11-13 | — | — | EP | disclosed |
| WO-1991008203-A1 | NOVEL THIAZOLIDINONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR PREPARING SAME | Richter Gedeon Vegyészeti Gyár Rt. (HU) | 1991-06-13 | — | — | WO | disclosed |