Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | DHODH | Q02127 | 1/20 | 0.34 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.34 |
| ▸ | ANO1 | Q5XXA6 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | RORC | P51449 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | PDE7A | Q13946 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16167675 | 0.89 | ALDH1A1 (0.39) | ALDH1A1DHODHAVPR1AANO1LMNA | |
| SCHEMBL16167674 | 0.81 | AVPR1A (0.37) | ALDH1A1DHODHAVPR1AUSP2LMNA | |
| SCHEMBL7911467 | 0.80 | ALDH1A1 (0.39) | ALDH1A1AVPR1ALMNAHTTPOLB | |
| SCHEMBL7908197 | 0.79 | ALDH1A1 (0.38) | ALDH1A1AVPR1ALMNAMAPTKMT2A | |
| SCHEMBL7909327 | 0.78 | AVPR1A (0.39) | ALDH1A1OPRM1OPRD1DHODHAVPR1A | |
| SCHEMBL7914828 | 0.78 | AVPR1A (0.39) | ALDH1A1AVPR1ALMNAMAPTKMT2A | |
| SCHEMBL7909318 | 0.78 | AVPR1A (0.37) | ALDH1A1DHODHAVPR1ALMNAMAPT | |
| SCHEMBL7908194 | 0.78 | KMT2A (0.38) | ALDH1A1AVPR1ALMNAMAPTKMT2A | |
| SCHEMBL16167673 | 0.77 | HSD11B1 (0.40) | ALDH1A1AVPR1AHTTKMT2A | |
| SCHEMBL2511918 | 0.69 | HSD11B1 (0.46) | ALDH1A1LMNAHTTPOLBMAPT |
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-2010063402-A1 | SUBSTITUTED BENZYL AND PHENYLSULFONYL TRIAZOLONES, AND USE THEREOF | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2010-06-10 | — | — | WO | disclosed |