Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | GMNN | O75496 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Water SCHEMBL28094977 | 0.68 | — | — | |
| SCHEMBL6642097 | 0.67 | NOS3 (0.30) | ALOX15ALDH1A1MAPK10HSD17B10NOS3 | |
| SCHEMBL7606329 | 0.67 | NOS3 (0.30) | ALOX15ALDH1A1MAPK10HSD17B10NOS3 | |
| SCHEMBL28070772 | 0.67 | — | — | |
| SCHEMBL26535672 | 0.67 | ALDH1A1 (0.47) | ALOX15ALDH1A1MAPK10HSD17B10KDM4E | |
| SCHEMBL9586154 | 0.66 | SMN1; SMN2 (0.33) | KDM4EMAPTSMN1; SMN2GAAHPGD | |
| SCHEMBL9384302 | 0.66 | — | — | |
| SCHEMBL9850706 | 0.66 | ALDH1A1 (0.36) | ALOX15ALDH1A1MAPK10HSD17B10KDM4E | |
| SCHEMBL15539282 | 0.65 | ALDH1A1 (0.36) | ALOX15ALDH1A1MAPK10HSD17B10KDM4E | |
| SCHEMBL31001735 | 0.65 | ALDH1A1 (0.36) | ALOX15ALDH1A1MAPK10HSD17B10KDM4E |
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-5171743-A | Compounds composition and use of substituted 1,3-dithiolo- and 1,4-dithino-pyridines as an antimicrobial | THE DOW CHEMICAL COMPANY (US) | 1992-12-15 | — | — | US | disclosed |
| US-5171743-A | Compounds composition and use of substituted 1,3-dithiolo- and 1,4-dithino-pyridines as an antimicrobial | THE DOW CHEMICAL COMPANY (US) | 1992-12-15 | — | — | US | disclosed |