Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.31 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2452337 | 1.00 | ALDH1A1 (0.34) | ALDH1A1LMNACYP3A4TSHRHSD17B10 | |
| SCHEMBL2455744 | 0.89 | FPR3 (0.33) | ALDH1A1EPHX2 | |
| SCHEMBL2455747 | 0.89 | FPR3 (0.33) | ALDH1A1EPHX2 | |
| SCHEMBL337263 | 0.84 | CYP3A4 (0.32) | ALDH1A1CYP3A4TSHRHSD17B10EPHX2 | |
| SCHEMBL2452733 | 0.82 | — | — | |
| SCHEMBL2452729 | 0.82 | — | — | |
| SCHEMBL28527648 | 0.78 | CYP3A4 (0.32) | CYP3A4RAB9ASMN1; SMN2 | |
| SCHEMBL28525796 | 0.78 | CYP3A4 (0.32) | CYP3A4RAB9ASMN1; SMN2 | |
| SCHEMBL2489651 | 0.76 | MEN1 (0.37) | ALDH1A1LMNACYP3A4TSHR | |
| SCHEMBL2454512 | 0.76 | MEN1 (0.37) | ALDH1A1LMNACYP3A4TSHR |
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-2366700-A1 | Pyrrolidine-thioxopyrimidinone/thiohydantoin organocatolysts | National and Kapodistrian Universty of Athens (GR) | 2011-09-21 | — | — | EP | disclosed |