Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGK1 | P00558 | 1/20 | 0.56 |
| ▸ | PGK2 | P07205 | 1/20 | 0.56 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.42 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.38 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8925129 | 0.81 | UTRN (0.39) | AKR1C4AKR1C3AKR1C2AKR1C1ALDH1A1 | |
| SCHEMBL8992172 | 0.78 | PGK1 (0.53) | PGK1PGK2HSD17B10 | |
| SCHEMBL8922756 | 0.77 | CYP2A6 (0.42) | AKR1C4AKR1C3AKR1C2AKR1C1ESR1 | |
| SCHEMBL839035 | 0.76 | CYP2A6 (0.56) | ESR1ESR2ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL8923309 | 0.76 | MEN1 (0.65) | HSD17B10 | |
| SCHEMBL8923310 | 0.76 | MEN1 (0.65) | HSD17B10 | |
| SCHEMBL29616518 | 0.74 | PGK1 (0.50) | PGK1PGK2CYP1A2PTPN1 | |
| SCHEMBL915502 | 0.74 | PGK1 (0.50) | PGK1PGK2CYP1A2PTPN1 | |
| Phosphoric Acid SCHEMBL30173246 | 0.74 | ESR1 (0.61) | ESR1ESR2CYP1A2ALOX5PTPN1 | |
| SCHEMBL9657892 | 0.74 | PGK1 (0.91) | PGK1PGK2 |
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-5489717-A | Glutamate (NMDA) receptor antagonists | WARNER-LAMBERT COMPANY | 1996-02-06 | — | — | US | disclosed |