Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | DNM1 | Q05193 | 5/20 | 0.48 |
| ▸ | EPHX2 | P34913 | 6/20 | 0.46 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.42 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.42 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.42 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.42 |
| ▸ | CES2 | O00748 | 3/20 | 0.41 |
| ▸ | CES1 | P23141 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | GGPS1 | O95749 | 3/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11256990 | 1.00 | ALDH1A1 (0.48) | ALDH1A1TSHRDNM1EPHX2S1PR2 | |
| SCHEMBL11243175 | 1.00 | ALDH1A1 (0.48) | ALDH1A1TSHRDNM1EPHX2S1PR2 | |
| SCHEMBL7594880 | 1.00 | ALDH1A1 (0.48) | ALDH1A1TSHRDNM1EPHX2S1PR2 | |
| SCHEMBL2576617 | 1.00 | ALDH1A1 (0.48) | ALDH1A1TSHRDNM1EPHX2S1PR2 | |
| SCHEMBL3244441 | 1.00 | ALDH1A1 (0.48) | ALDH1A1TSHRDNM1EPHX2S1PR2 | |
| SCHEMBL9698119 | 1.00 | ALDH1A1 (0.48) | ALDH1A1TSHRDNM1EPHX2S1PR2 | |
| SCHEMBL9699184 | 0.98 | ALDH1A1 (0.44) | ALDH1A1TSHRDNM1EPHX2S1PR2 | |
| SCHEMBL5286753 | 0.91 | — | — | |
| SCHEMBL11680465 | 0.82 | FAAH (0.39) | ALDH1A1TSHREPHX2 | |
| SCHEMBL11046710 | 0.81 | EPHX2 (0.62) | ALDH1A1TSHRDNM1EPHX2S1PR2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0486958-A1 | Physostigmine derivatives | MEDIOLANUM FARMACEUTICI s.r.l. (IT) | 1992-05-27 | — | — | EP | disclosed |