Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 14/20 | 0.54 |
| ▸ | AKR1C2 | P52895 | 14/20 | 0.54 |
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.51 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.46 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.46 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.44 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9063835 | 0.87 | AKR1C3 (0.51) | AKR1C3AKR1C2AKR1C1PTGS1AKR1B10 | |
| SCHEMBL6017403 | 0.86 | AKR1C3 (0.64) | AKR1C3AKR1C2AKR1C1PTGS1 | |
| SCHEMBL30730198 | 0.86 | AKR1C3 (0.64) | AKR1C3AKR1C2AKR1C1PTGS1 | |
| SCHEMBL14192004 | 0.86 | AKR1C3 (0.64) | AKR1C3AKR1C2AKR1C1PTGS1 | |
| SCHEMBL2656910 | 0.84 | AKR1C3 (0.55) | AKR1C3AKR1C2AKR1C1PTGS1AKR1B10 | |
| SCHEMBL585600 | 0.83 | AKR1C3 (0.54) | AKR1C3AKR1C2AKR1C1PTGS1AKR1B10 | |
| SCHEMBL11193984 | 0.81 | AKR1C3 (0.53) | AKR1C3AKR1C2AKR1C1PTGS1AKR1B10 | |
| SCHEMBL28772896 | 0.81 | AKR1C3 (0.44) | AKR1C3AKR1C2AKR1C1PTGS1AKR1B10 | |
| SCHEMBL1556908 | 0.80 | AKR1C3 (0.51) | AKR1C3AKR1C2AKR1C1PTGS1AKR1B10 | |
| SCHEMBL20943203 | 0.80 | AKR1C3 (0.51) | AKR1C3AKR1C2AKR1C1PTGS1AKR1B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-4390723-A | BIS(8-QUINOLINOLATE) COPPER COMPLEX CATALYST | IHARA CHEMICAL INDUSTRY CO., LTD. (JP) | 1983-06-28 | — | — | US | claimed |
| US-4390723-A | BIS(8-QUINOLINOLATE) COPPER COMPLEX CATALYST | IHARA CHEMICAL INDUSTRY CO., LTD. (JP) | 1983-06-28 | — | — | US | disclosed |