Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA1 | P02708 | 1/20 | 0.35 |
| ▸ | CHRNG | P07510 | 1/20 | 0.35 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | CHRND | Q07001 | 1/20 | 0.35 |
| ▸ | PNMT | P11086 | 3/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.34 |
| ▸ | DRD2 | P14416 | 3/20 | 0.33 |
| ▸ | DRD3 | P35462 | 3/20 | 0.33 |
| ▸ | KDM1A | O60341 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | TNKS | O95271 | 1/20 | 0.33 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | CXCR5 | P32302 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 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 | |
|---|---|---|---|---|
| SCHEMBL23481105 | 0.73 | PNMT (0.41) | CHRNA1CHRNGCHRNB1CHRNB2CHRNB4 | |
| SCHEMBL8898195 | 0.73 | HTR2A (0.50) | KDM4ESLC6A4SLC6A2SLC6A3 | |
| SCHEMBL8896169 | 0.71 | KDM4E (0.36) | CHRNA1CHRNGCHRNB1CHRNB2CHRNB4 | |
| SCHEMBL29618332 | 0.70 | PNMT (0.44) | CHRNA1CHRNGCHRNB1CHRNB2CHRNB4 | |
| SCHEMBL15617616 | 0.68 | CHRNA1 (0.37) | CHRNA1CHRNGCHRNB1CHRNB2CHRNB4 | |
| SCHEMBL6808267 | 0.68 | KDM4E (0.37) | CHRNA1CHRNGCHRNB1CHRNB2CHRNB4 | |
| SCHEMBL8899294 | 0.68 | PNMT (0.37) | PNMTABCB1DRD2DRD3KDM1A | |
| SCHEMBL6808079 | 0.68 | SLC6A4 (0.40) | CHRNA1CHRNGCHRNB1CHRNB2CHRNB4 | |
| SCHEMBL2812487 | 0.67 | KMT2A (0.45) | KDM1ASLC6A4 | |
| SCHEMBL1686 | 0.67 | FADS1 (0.40) | DRD2DRD3KDM4ESLC6A4SLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0587110-B1 | Condensed heterocyclic derivatives and agricultural or horticultural fungicides containing the same | KUMIAI CHEMICAL INDUSTRY CO (JP) | 1997-12-17 | — | — | EP | disclosed |
| US-5348976-A | Amide derivatives as fungicides safe for plants | KUMAI CHEMICAL INDUSTRY CO., LTD. (JP) | 1994-09-20 | — | — | US | disclosed |
| EP-0587110-A2 | Condensed heterocyclic derivatives and agricultural or horticultural fungicides containing the same | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 1994-03-16 | — | — | EP | disclosed |