Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.38 |
| ▸ | MMP13 | P45452 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | GABRP | O00591 | 1/20 | 0.36 |
| ▸ | GABRD | O14764 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.36 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.36 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.36 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.36 |
| ▸ | GABRE | P78334 | 1/20 | 0.36 |
| ▸ | GABRA6 | Q16445 | 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 | |
|---|---|---|---|---|
| SCHEMBL5085404 | 0.76 | EIF4E (0.35) | ALDH1A1TDP1KEAP1NFE2L2LMNA | |
| SCHEMBL29714781 | 0.73 | TSHR (0.59) | ALDH1A1TDP1KEAP1NFE2L2MMP13 | |
| SCHEMBL9292967 | 0.73 | TSHR (0.59) | ALDH1A1TDP1KEAP1NFE2L2MMP13 | |
| SCHEMBL23571214 | 0.72 | TSHR (0.57) | ALDH1A1TDP1KEAP1NFE2L2MMP13 | |
| SCHEMBL3411312 | 0.71 | BRD4 (0.36) | MMP13GABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL4649697 | 0.70 | TDP1 (0.40) | ALDH1A1TDP1KEAP1NFE2L2LMNA | |
| SCHEMBL2331528 | 0.69 | ALDH1A1 (0.65) | ALDH1A1TDP1GABRPGABRDGABRA1 | |
| SCHEMBL4427520 | 0.69 | TSHR (0.35) | ALDH1A1LMNATSHRKMT2AMEN1 | |
| SCHEMBL8499229 | 0.69 | ALDH1A1 (0.54) | ALDH1A1TDP1TSHRGABRPGABRD | |
| SCHEMBL85551 | 0.69 | TSHR (0.70) | ALDH1A1TDP1KEAP1NFE2L2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008091594-A2 | FUNGICIDAL MIXTURES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2008-07-31 | — | — | WO | disclosed |