Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.45 |
| ▸ | MAOA | P21397 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4770852 | 0.75 | GPBAR1 (0.61) | ALDH1A1MAPK1L3MBTL1GPBAR1MAOA | |
| SCHEMBL13543685 | 0.70 | GPBAR1 (0.56) | ALDH1A1MAPK1L3MBTL1GPBAR1MAOA | |
| SCHEMBL23996454 | 0.69 | ALDH1A1 (0.52) | ALDH1A1MAPK1L3MBTL1TP53HTT | |
| SCHEMBL19295478 | 0.68 | NOTUM (0.71) | ALDH1A1L3MBTL1GPBAR1TP53ALOX12 | |
| SCHEMBL9996735 | 0.67 | PIM1 (0.43) | ALDH1A1MAPK1L3MBTL1GPBAR1TP53 | |
| SCHEMBL28288415 | 0.67 | HSD11B1 (0.54) | ALDH1A1NR4A3 | |
| SCHEMBL156901 | 0.67 | HTT (0.60) | ALDH1A1L3MBTL1HTTSMN1; SMN2TSHR | |
| SCHEMBL13325671 | 0.66 | ALDH1A1 (0.50) | ALDH1A1TP53ALOX12HTTTSHR | |
| SCHEMBL4771914 | 0.65 | HTT (0.64) | ALDH1A1MAPK1GPBAR1MAOATP53 | |
| SCHEMBL17595339 | 0.65 | ALDH1A1 (0.61) | ALDH1A1L3MBTL1GPBAR1GAATP53 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0842158-A1 | MICROBICIDAL 2-PHENYLETHYL-MERCAPTO-TRIAZOLES | BAYER AG (DE) | 1998-05-20 | — | — | EP | claimed |
| WO-1997005119-A1 | MICROBICIDAL 2-PHENYLETHYL-MERCAPTO-TRIAZOLES | BAYER AKTIENGESELLSCHAFT (DE) | 1997-02-13 | — | — | WO | claimed |