Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 1.00 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 1.00 |
| ▸ | MAPT | P10636 | 5/20 | 1.00 |
| ▸ | NPC1 | O15118 | 5/20 | 1.00 |
| ▸ | RAB9A | P51151 | 5/20 | 1.00 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.67 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.63 |
| ▸ | MEN1 | O00255 | 5/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.62 |
| ▸ | MAOA | P21397 | 1/20 | 0.62 |
| ▸ | POLB | P06746 | 1/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.61 |
| ▸ | CASP3 | P42574 | 2/20 | 0.59 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.59 |
| ▸ | HPGD | P15428 | 3/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL4296357 | 0.95 | ALDH1A1 (0.91) | ALDH1A1SMN1; SMN2MAPTNPC1RAB9A | |
| SCHEMBL4293737 | 0.89 | ALDH1A1 (0.80) | ALDH1A1SMN1; SMN2MAPTNPC1RAB9A | |
| SCHEMBL4300016 | 0.88 | ALDH1A1 (0.78) | ALDH1A1SMN1; SMN2MAPTNPC1RAB9A | |
| SCHEMBL10114017 | 0.84 | ALDH1A1 (0.71) | ALDH1A1SMN1; SMN2MAPTNPC1RAB9A | |
| SCHEMBL10113215 | 0.83 | ALDH1A1 (0.70) | ALDH1A1SMN1; SMN2MAPTNPC1RAB9A | |
| SCHEMBL13203760 | 0.83 | ALDH1A1 (0.70) | ALDH1A1SMN1; SMN2MAPTNPC1RAB9A | |
| SCHEMBL12857936 | 0.81 | CASP3 (0.78) | ALDH1A1SMN1; SMN2MAPTNPC1RAB9A | |
| SCHEMBL22336287 | 0.78 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2MAPTNPC1RAB9A | |
| SCHEMBL22321715 | 0.77 | ACE2 (0.71) | ALDH1A1SMN1; SMN2MAPTNPC1RAB9A | |
| SCHEMBL2812760 | 0.77 | MAOA (1.00) | ALDH1A1SMN1; SMN2MAPTNPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-5385842-A | Anthraquinones as inhibitors of sulfide production from sulfate-reducing bacteria | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1995-01-31 | — | — | US | disclosed |
| EP-0525073-B1 | ANTHRAQUINONES AS INHIBITORS OF SULFIDE PRODUCTION FROM SULFATE-REDUCING BACTERIA | DU PONT (US) | 1994-05-25 | — | — | EP | disclosed |
| EP-0525073-A1 | ANTHRAQUINONES AS INHIBITORS OF SULFIDE PRODUCTION FROM SULFATE-REDUCING BACTERIA. | DU PONT (US) | 1993-02-03 | — | — | EP | disclosed |
| WO-1991015954-A1 | ANTHRAQUINONES AS INHIBITORS OF SULFIDE PRODUCTION FROM SULFATE-REDUCING BACTERIA | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1991-10-31 | — | — | WO | disclosed |