Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | HMGCR | P04035 | 1/20 | 0.34 |
| ▸ | LDHA | P00338 | 1/20 | 0.34 |
| ▸ | STING1 | Q86WV6 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7180787 | 0.81 | CYP2C19 (0.41) | CYP2C19KDM4EALDH1A1HPGDHTT | |
| SCHEMBL8459648 | 0.80 | CYP2C19 (0.40) | CYP2C19KDM4EALDH1A1TAAR1HPGD | |
| SCHEMBL7279487 | 0.74 | AOC3 (0.45) | KDM4EALDH1A1TAAR1MAPTHMGCR | |
| SCHEMBL1699372 | 0.72 | HPGD (0.52) | ALDH1A1HPGDHTTHSD17B10SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL7273721 | 0.69 | TAAR1 (0.46) | KDM4ETAAR1MEN1KMT2AATM | |
| SCHEMBL9786067 | 0.69 | HSD17B10 (0.51) | KDM4EALDH1A1TAAR1HPGDTDP1 | |
| SCHEMBL7283185 | 0.68 | AOC3 (0.39) | KDM4EALDH1A1HMGCRSMN1; SMN2 | |
| SCHEMBL8357110 | 0.67 | KDM4E (0.47) | CYP2C19KDM4EALDH1A1TAAR1HPGD | |
| SCHEMBL490774 | 0.67 | LDHA (0.56) | KDM4EHPGDHTTTDP1MAPT | |
| SCHEMBL490831 | 0.67 | MAPT (0.46) | KDM4EALDH1A1HPGDTDP1MAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0980350-A4 | HYDROXYNAPHTHOIC ACIDS AND DERIVATIVES | UNIV NEW MEXICO (US) | 2003-01-02 | — | — | EP | disclosed |
| US-6124498-A | Hydroxynaphthoic acids and derivatives | UNIVERSITY OF NEW MEXICO (US) | 2000-09-26 | — | — | US | disclosed |
| EP-0980350-A2 | HYDROXYNAPHTHOIC ACIDS AND DERIVATIVES | The University of New Mexico (US) | 2000-02-23 | — | — | EP | disclosed |
| WO-1998049130-A2 | HYDROXYNAPHTHOIC ACIDS AND DERIVATIVES | THE UNIVERSITY OF NEW MEXICO (US) | 1998-11-05 | — | — | WO | disclosed |