Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.54 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.54 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 5/20 | 0.48 |
| ▸ | RAB9A | P51151 | 5/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.47 |
| ▸ | HPGD | P15428 | 5/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | STAT1 | P42224 | 1/20 | 0.44 |
| ▸ | NQO1 | P15559 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8945424 | 0.93 | LMNA (0.50) | AKR1C3AKR1C2AKR1C1NPC1RAB9A | |
| SCHEMBL8945588 | 0.86 | KDM4E (0.49) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL8945584 | 0.83 | NQO1 (0.38) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL8945669 | 0.82 | ALDH1A1 (0.55) | KMT2AMEN1ALDH1A1KDM4EHPGD | |
| SCHEMBL8945541 | 0.81 | NQO1 (0.40) | KMT2AMEN1ALDH1A1KDM4EMAPT | |
| SCHEMBL8945416 | 0.80 | NQO1 (0.47) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL8945409 | 0.78 | NQO1 (0.40) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL8945501 | 0.76 | NQO1 (0.41) | KMT2AMEN1ALDH1A1KDM4EMAPT | |
| SCHEMBL8945493 | 0.73 | AKR1C3 (0.52) | AKR1C3AKR1C2AKR1C1NPC1RAB9A | |
| SCHEMBL6275581 | 0.72 | AKR1C3 (0.58) | AKR1C3AKR1C2AKR1C1NPC1RAB9A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5510375-A | VIRICIDES TREATING INFECTION CAUSED BY HUMAN IMMUNODEFICIENCY VIRUS AND AIDS | WARNER-LAMBERT COMPANY (US) | 1996-04-23 | — | — | US | disclosed |