Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.51 |
| ▸ | NPC1 | O15118 | 5/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.42 |
| ▸ | FEN1 | P39748 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28308753 | 0.76 | GAA (0.52) | ALDH1A1NPC1MAPTHPGDSMN1; SMN2 | |
| SCHEMBL10331123 | 0.75 | ALDH1A1 (0.61) | ALDH1A1NPC1MAPTHPGDSMN1; SMN2 | |
| SCHEMBL4659374 | 0.73 | MTNR1A (0.46) | ALDH1A1NPC1MAPTHPGDSMN1; SMN2 | |
| SCHEMBL7584602 | 0.73 | MTNR1A (0.46) | ALDH1A1NPC1MAPTHPGDSMN1; SMN2 | |
| SCHEMBL4659375 | 0.73 | MTNR1A (0.46) | ALDH1A1NPC1MAPTHPGDSMN1; SMN2 | |
| SCHEMBL13461 | 0.72 | CES2 (0.65) | ALDH1A1NPC1MAPTHPGDSMN1; SMN2 | |
| SCHEMBL29593208 | 0.72 | CES2 (0.65) | ALDH1A1NPC1MAPTHPGDSMN1; SMN2 | |
| SCHEMBL27598162 | 0.72 | CES2 (0.54) | ALDH1A1NPC1MAPTHPGDSMN1; SMN2 | |
| SCHEMBL20004298 | 0.71 | GAA (0.42) | ALDH1A1NPC1MAPTHPGDSMN1; SMN2 | |
| SCHEMBL9211931 | 0.71 | CES2 (0.58) | ALDH1A1NPC1MAPTHPGDSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009138440-A1 | CARBAMOYL DERIVATIVES OF BICYCLIC CARBONYLAMINO-PYRAZOLES AS PRODRUGS | NERVIANO MEDICAL SCIENCES S.R.L. (IT) | 2009-11-19 | — | — | WO | disclosed |