Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | HTR6 | P50406 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ABCC9 | O60706 | 2/20 | 0.36 |
| ▸ | ABCC8 | Q09428 | 2/20 | 0.36 |
| ▸ | KCNJ11 | Q14654 | 2/20 | 0.36 |
| ▸ | KCNJ8 | Q15842 | 2/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.36 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA7 | P43166 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10746711 | 0.77 | KMT2A (0.49) | ALDH1A1HTR6HTTMAPK1MAPT | |
| SCHEMBL9864782 | 0.72 | PSIP1 (0.31) | — | |
| SCHEMBL11121243 | 0.70 | HTR6 (0.52) | ALDH1A1LMNAHPGDHTR6KDM4E | |
| SCHEMBL19259882 | 0.70 | LOX (0.53) | ALDH1A1LMNAHPGDHTR6ABCB1 | |
| SCHEMBL1146161 | 0.69 | HSD11B1 (0.59) | ALDH1A1LMNAHPGDHTR6KDM4E | |
| SCHEMBL19259785 | 0.69 | LOX (0.54) | ALDH1A1LMNAHPGDHTR6ABCB1 | |
| SCHEMBL11018738 | 0.67 | ALDH1A1 (0.53) | ALDH1A1LMNAHPGDHTR6KDM4E | |
| SCHEMBL6401035 | 0.67 | ALDH1A1 (0.55) | ALDH1A1LMNAHPGDHTR6KDM4E | |
| SCHEMBL11120054 | 0.67 | ALDH1A1 (0.55) | ALDH1A1LMNAHPGDHTR6KDM4E | |
| SCHEMBL4194000 | 0.67 | ACLY (0.51) | ALDH1A1LMNAHPGDHTR6KDM4E |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1017243-B | THIO COMPOUNDS HAVING FUNGICIDAL ACTIVITY | DUPHAR INT RES (NL) | 1992-07-01 | — | — | CN | disclosed |
| US-4994485-A | Seed and soil fungi, bacteria | DUPHAR INTERNATIONAL RESEARCH B.V. (NL) | 1991-02-19 | — | — | US | disclosed |
| EP-0234622-B1 | NEW THIO COMPOUNDS HAVING FUNGICIDAL ACTIVITY | DUPHAR INTERNATIONAL RESEARCH B.V (NL) | 1990-06-27 | — | — | EP | disclosed |
| CN-87101917-A | Has the active novel sulfurized compound of antifungal | — | 1988-01-06 | — | — | CN | disclosed |
| EP-0234622-A1 | New thio compounds having fungicidal activity | DUPHAR INTERNATIONAL RESEARCH B.V (NL) | 1987-09-02 | — | — | EP | disclosed |