Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.44 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.43 |
| ▸ | MMP1 | P03956 | 1/20 | 0.43 |
| ▸ | MMP2 | P08253 | 1/20 | 0.43 |
| ▸ | MMP3 | P08254 | 1/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
| ▸ | MMP8 | P22894 | 1/20 | 0.43 |
| ▸ | MMP12 | P39900 | 1/20 | 0.43 |
| ▸ | MMP13 | P45452 | 1/20 | 0.43 |
| ▸ | MMP14 | P50281 | 1/20 | 0.43 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.42 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.42 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28190404 | 0.85 | IDO1 (0.47) | MAOBLMNAHTTCES2CES1 | |
| SCHEMBL15658852 | 0.85 | PPARA (0.55) | MAOBLMNAHTTCES2CES1 | |
| SCHEMBL2442200 | 0.85 | EPHX2 (0.47) | LMNANR4A2HDAC1HDAC8 | |
| SCHEMBL9626513 | 0.81 | RIPK1 (0.47) | MAOB | |
| SCHEMBL9200306 | 0.81 | GSK3B (0.50) | MAOBLMNAHTTCES2CES1 | |
| SCHEMBL8951998 | 0.79 | HPGD (0.44) | MAOBLMNACES2CES1SRD5A2 | |
| SCHEMBL15659870 | 0.78 | NPSR1 (0.46) | MAOBMMP8PPARA | |
| SCHEMBL10465337 | 0.77 | EPHX2 (0.49) | LMNAHTTPTPN1 | |
| SCHEMBL10741181 | 0.77 | EPHX2 (0.49) | PPARAHDAC1HDAC8 | |
| SCHEMBL5728540 | 0.77 | CES2 (0.41) | LMNACES2CES1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0649416-A1 | TRIAZOLYLBUTANE DERIVATIVES WITH A FUNGICIDAL ACTION | BAYER AG (DE) | 1995-04-26 | — | — | EP | claimed |
| WO-1994001418-A1 | TRIAZOLYLBUTANE DERIVATIVES WITH A FUNGICIDAL ACTION | BAYER AKTIENGESELLSCHAFT (DE) | 1994-01-20 | — | — | WO | claimed |
| EP-0649416-A1 | TRIAZOLYLBUTANE DERIVATIVES WITH A FUNGICIDAL ACTION | BAYER AG (DE) | 1995-04-26 | — | — | EP | disclosed |
| WO-1994001418-A1 | TRIAZOLYLBUTANE DERIVATIVES WITH A FUNGICIDAL ACTION | BAYER AKTIENGESELLSCHAFT (DE) | 1994-01-20 | — | — | WO | disclosed |