Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERCC1 | P07992 | 4/20 | 0.60 |
| ▸ | ERCC4 | Q92889 | 4/20 | 0.60 |
| ▸ | ALPL | P05186 | 4/20 | 0.56 |
| ▸ | ALPG | P10696 | 4/20 | 0.56 |
| ▸ | PLAA | Q9Y263 | 1/20 | 0.56 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | TOP1 | P11387 | 3/20 | 0.50 |
| ▸ | ESR1 | P03372 | 1/20 | 0.49 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL9768311 | 0.87 | ERCC1 (0.51) | ERCC1ERCC4ALPLALPGPLAA | |
| Hydrochloric Acid SCHEMBL11272887 | 0.84 | AKR1C3 (0.50) | ERCC1ERCC4ALPLALPGPLAA | |
| SCHEMBL9768023 | 0.84 | ALPL (0.51) | ERCC1ERCC4ALPLALPGPLAA | |
| SCHEMBL9768193 | 0.84 | CA12 (0.61) | ERCC1ERCC4ALPLALPGPLAA | |
| SCHEMBL9768107 | 0.84 | ALPL (0.51) | ERCC1ERCC4ALPLALPGPLAA | |
| SCHEMBL9768082 | 0.84 | ALPL (0.51) | ERCC1ERCC4ALPLALPGPLAA | |
| SCHEMBL9768265 | 0.83 | AKR1C3 (0.64) | ERCC1ERCC4ALPLALPGPLAA | |
| SCHEMBL9768088 | 0.83 | AKR1C3 (0.49) | ERCC1ERCC4ALPLALPGPLAA | |
| SCHEMBL9768099 | 0.83 | AKR1C3 (0.49) | ERCC1ERCC4ALPLALPGPLAA | |
| SCHEMBL9768241 | 0.83 | AKR1C3 (0.49) | ERCC1ERCC4ALPLALPGPLAA |
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-5047592-A | Selective hydrogenolysis process | ETHYL CORPORATION (US) | 1991-09-10 | — | — | US | disclosed |