Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | LPL | P06858 | 1/20 | 0.35 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7776316 | 0.82 | TRPA1 (0.37) | ALDH1A1TRPA1CA2LPLLIPG | |
| SCHEMBL7242031 | 0.82 | TRPA1 (0.37) | ALDH1A1TRPA1CA2LPLLIPG | |
| SCHEMBL3199130 | 0.82 | ALDH1A1 (0.42) | ALDH1A1TRPA1CA2LPLLIPG | |
| SCHEMBL44351 | 0.80 | ALDH1A1 (0.62) | ALDH1A1TRPA1CA2GABRA1GABRB2 | |
| SCHEMBL1684421 | 0.77 | ALDH1A1 (0.62) | ALDH1A1TRPA1CA2GABRA1GABRB2 | |
| SCHEMBL7768714 | 0.77 | ALDH1A1 (0.62) | ALDH1A1TRPA1CA2GABRA1GABRB2 | |
| SCHEMBL28919832 | 0.76 | SELL (0.37) | ALDH1A1TRPA1CA2KDM4EHPGD | |
| SCHEMBL911111 | 0.70 | CA2 (0.36) | TRPA1CA2LPLLIPGCYP1A2 | |
| SCHEMBL106989 | 0.69 | TRPA1 (0.57) | ALDH1A1TRPA1CA2CYP1A2KDM4E | |
| SCHEMBL21861870 | 0.69 | ALDH1A1 (0.50) | ALDH1A1TRPA1CA2GABRA1GABRB2 |
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-2012076877-A1 | HYDANTOIN DERIVATIVES USEFUL AS KV3 INHIBITORS | AUTIFONY THERAPEUTICS LIMITED (GB) | 2012-06-14 | — | — | WO | disclosed |