Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 4/20 | 0.39 |
| ▸ | MPO | P05164 | 4/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.36 |
| ▸ | MAOB | P27338 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7571942 | 0.89 | AR (0.36) | IDO1MPOALDH1A1MAOBKDM4E | |
| SCHEMBL7989824 | 0.85 | ALDH1A1 (0.39) | IDO1ALDH1A1MAOBKDM4EGAA | |
| SCHEMBL7986289 | 0.85 | IDO1 (0.38) | IDO1ALDH1A1MAOBMAPTL3MBTL1 | |
| SCHEMBL7989289 | 0.84 | CA1 (0.42) | IDO1ALDH1A1MAOBGAAMEN1 | |
| SCHEMBL7976011 | 0.84 | CA1 (0.45) | IDO1GAAMEN1KMT2ATP53 | |
| SCHEMBL7509426 | 0.84 | MPO (0.41) | IDO1MPOALDH1A1MAOBKDM4E | |
| SCHEMBL7508198 | 0.84 | TDP1 (0.33) | IDO1ALDH1A1MAOBKDM4EGAA | |
| SCHEMBL7989311 | 0.83 | CA1 (0.44) | IDO1ALDH1A1GAAMEN1KMT2A | |
| SCHEMBL7987648 | 0.82 | HSP90AA1 (0.39) | IDO1SLC6A4ALDH1A1MAOBKDM4E | |
| SCHEMBL7986153 | 0.80 | LMNA (0.39) | IDO1ALDH1A1MAOBKDM4EMEN1 |
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-1175385-A1 | D-MANNITOL DERIVATIVES AS HIV ASPARTYL PROTEASE INHIBITORS | Pharmacor Inc. (CA) | 2002-01-30 | — | — | EP | disclosed |
| WO-2000066524-A1 | D-MANNITOL DERIVATIVES AS HIV ASPARTYL PROTEASE INHIBITORS | PHARMACOR INC. (CA) | 2000-11-09 | — | — | WO | disclosed |