Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 7/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.43 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | MGLL | Q99685 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 2/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.42 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8741183 | 0.88 | ALOX5 (0.53) | ALDH1A1GAAKDM4EMAPTKMT2A | |
| SCHEMBL29176247 | 0.79 | CES2 (0.52) | ALDH1A1GAAKDM4EMAPTKMT2A | |
| SCHEMBL833353 | 0.73 | ALDH1A1 (0.57) | ALDH1A1GAAKDM4EMAPTKMT2A | |
| SCHEMBL866755 | 0.72 | ALDH1A1 (0.41) | ALDH1A1GAAKDM4EMAPTKMT2A | |
| SCHEMBL10493588 | 0.69 | MAPT (0.61) | ALDH1A1GAAMAPTKMT2AMEN1 | |
| SCHEMBL11575089 | 0.68 | ALDH1A1 (0.50) | ALDH1A1GAAKDM4EMAPTKMT2A | |
| SCHEMBL29929890 | 0.68 | LMNA (0.56) | ALDH1A1MAPTKMT2AMEN1TDP1 | |
| SCHEMBL57616 | 0.68 | LMNA (0.56) | ALDH1A1MAPTKMT2AMEN1TDP1 | |
| SCHEMBL8925933 | 0.68 | ALOX5 (0.60) | ALDH1A1GAAMAPTKMT2AMEN1 | |
| SCHEMBL28688755 | 0.68 | TSHR (0.47) | ALDH1A1MAPTKMT2AMEN1TDP1 |
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-0772597-A1 | 3,4-SUBSTITUTED PYRAZOLES FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1997-05-14 | — | — | EP | disclosed |
| WO-1996003385-A1 | 3,4-SUBSTITUTED PYRAZOLES FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1996-02-08 | — | — | WO | disclosed |