Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | AKR1C3 | P42330 | 6/20 | 0.55 |
| ▸ | AKR1C1 | Q04828 | 3/20 | 0.55 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.55 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11079773 | 1.00 | HTT (0.55) | HTTALDH1A1AKR1C3AKR1C1AKR1C2 | |
| SCHEMBL6169410 | 0.93 | ALDH1A1 (0.55) | HTTALDH1A1AKR1C3AKR1C1AKR1C2 | |
| SCHEMBL6169411 | 0.93 | ALDH1A1 (0.55) | HTTALDH1A1AKR1C3AKR1C1AKR1C2 | |
| SCHEMBL5183481 | 0.87 | AKR1C1 (0.70) | HTTALDH1A1AKR1C3AKR1C1AKR1C2 | |
| SCHEMBL6172379 | 0.87 | AKR1C1 (0.70) | HTTALDH1A1AKR1C3AKR1C1AKR1C2 | |
| SCHEMBL7992874 | 0.87 | AKR1C1 (0.70) | HTTALDH1A1AKR1C3AKR1C1AKR1C2 | |
| SCHEMBL20184151 | 0.86 | AKR1C1 (0.75) | HTTALDH1A1AKR1C3AKR1C1AKR1C2 | |
| SCHEMBL7814861 | 0.86 | AKR1C1 (0.75) | HTTALDH1A1AKR1C3AKR1C1AKR1C2 | |
| SCHEMBL20415315 | 0.83 | ALDH1A1 (0.74) | HTTALDH1A1AKR1C3AKR1C1AKR1C2 | |
| SCHEMBL6168237 | 0.82 | AKR1C3 (0.59) | HTTALDH1A1AKR1C3AKR1C1AKR1C2 |
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-4442100-A | ANTILIPEMIC | BAYER AKTIENGESELLSCHAFT (DE) | 1984-04-10 | — | — | US | disclosed |