Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSIP1 | O75475 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | APLNR | P35414 | 4/20 | 0.40 |
| ▸ | F10 | P00742 | 7/20 | 0.38 |
| ▸ | F2 | P00734 | 1/20 | 0.38 |
| ▸ | F11 | P03951 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1381320 | 0.82 | PTGS2 (0.53) | F10PTGS2 | |
| SCHEMBL10059528 | 0.79 | CA12 (0.54) | PTGS2CA12CA1CA2CA9 | |
| SCHEMBL14490265 | 0.77 | MGLL (0.48) | GAAF10KDM4EALDH1A1CYP1A2 | |
| SCHEMBL14502379 | 0.75 | F10 (0.49) | GAAF10ALDH1A1 | |
| SCHEMBL92819 | 0.74 | KDM4E (0.57) | F10F2CA1CA2KDM4E | |
| SCHEMBL4694832 | 0.72 | F10 (0.49) | GAAF10F2ALDH1A1 | |
| SCHEMBL143175 | 0.72 | ALDH1A1 (0.54) | GAAF10KDM4EALDH1A1CYP1A2 | |
| SCHEMBL10455034 | 0.72 | PSIP1 (0.74) | PSIP1GAACA2ALDH1A1 | |
| SCHEMBL2645575 | 0.71 | DDB1 (0.41) | F10CA12CA1CA2CA9 | |
| SCHEMBL28203632 | 0.71 | KEAP1 (0.53) | F10PTGS2CA12CA1CA2 |
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-4517192-A | 6-Alkyl-5-[4-(alkylsulfinyl or alkylsulfonyl)phenyl]-2(1H)-pyridinones and their use as cardiatonics | STERLING DRUG INC. (US) | 1985-05-14 | — | — | US | disclosed |