Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.35 |
| ▸ | GLA | P06280 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 2/20 | 0.34 |
| ▸ | MMP1 | P03956 | 2/20 | 0.34 |
| ▸ | MMP2 | P08253 | 2/20 | 0.34 |
| ▸ | MMP9 | P14780 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9329459 | 1.00 | NPC1 (0.39) | NPC1RAB9APOLBLMNAALDH1A1 | |
| SCHEMBL9329463 | 1.00 | NPC1 (0.39) | NPC1RAB9APOLBLMNAALDH1A1 | |
| SCHEMBL9331437 | 0.88 | NPC1 (0.39) | NPC1RAB9APOLBLMNAALDH1A1 | |
| SCHEMBL9331430 | 0.88 | NPC1 (0.39) | NPC1RAB9APOLBLMNAALDH1A1 | |
| SCHEMBL9331425 | 0.88 | NPC1 (0.39) | NPC1RAB9APOLBLMNAALDH1A1 | |
| SCHEMBL7969238 | 0.82 | TRIM24 (0.40) | POLBALDH1A1CYP1A2SMN1; SMN2GAA | |
| SCHEMBL7958548 | 0.82 | TRIM24 (0.40) | POLBALDH1A1CYP1A2SMN1; SMN2GAA | |
| SCHEMBL9646097 | 0.75 | ALDH1A1 (0.41) | NPC1RAB9ALMNAALDH1A1CYP1A2 | |
| SCHEMBL9730293 | 0.75 | ALDH1A1 (0.41) | NPC1RAB9ALMNAALDH1A1CYP1A2 | |
| SCHEMBL9729795 | 0.75 | ALDH1A1 (0.41) | NPC1RAB9ALMNAALDH1A1CYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5336682-A | Heterocyclic compounds as fungicides | IMPERIAL CHEMICAL INDUSTRIES PUBLIC LIMITED COMPANY (GB) | 1994-08-09 | — | — | US | disclosed |
| US-5091407-A | HETEROCYCLIC COMPOUNDS AS FUNGICIDES | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-02-25 | — | — | US | disclosed |
| EP-0206523-A1 | Heterocyclic compounds as fungicides | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1986-12-30 | — | — | EP | disclosed |