Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 2/20 | 0.39 |
| ▸ | TYMS | P04818 | 2/20 | 0.39 |
| ▸ | PTGER3 | P43115 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 2/20 | 0.31 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7956310 | 0.77 | DHFR (0.44) | DHFRTYMSPTGER3KDM4EALDH1A1 | |
| SCHEMBL7955950 | 0.77 | DHFR (0.49) | DHFRTYMSKDM4EALDH1A1HPGD | |
| SCHEMBL7965270 | 0.74 | DHFR (0.47) | DHFRTYMSTSHRHTTUTS2R | |
| SCHEMBL6934430 | 0.68 | AKR1C2 (0.36) | PTGER3MCL1NPC1 | |
| SCHEMBL7971850 | 0.66 | ALDH1A1 (0.46) | DHFRTYMSKDM4EALDH1A1HPGD | |
| SCHEMBL29242851 | 0.63 | CYP2A6 (0.52) | CYP2D6ALDH1A1TSHRHSD17B10CYP1B1 | |
| SCHEMBL30901483 | 0.63 | CYP2A6 (0.52) | CYP2D6ALDH1A1TSHRHSD17B10CYP1B1 | |
| SCHEMBL9770063 | 0.63 | CYP2A6 (0.56) | ALDH1A1TSHRHSD17B10CYP1B1MAPT | |
| SCHEMBL31529637 | 0.63 | CYP2A6 (0.56) | ALDH1A1TSHRHSD17B10CYP1B1MAPT | |
| SCHEMBL7968980 | 0.62 | PTGER3 (0.35) | PTGER3TSHRMCL1NPC1 |
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-6265436-B1 | ANTIINFLAMMATORY AGENTS | OXIS THERAPEUTICS INC. | 2001-07-24 | — | — | US | disclosed |