Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | PPARD | Q03181 | 4/20 | 0.36 |
| ▸ | PPARA | Q07869 | 4/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP3 | P08254 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9862847 | 0.85 | CYP3A4 (0.55) | MAPTCYP3A4KMT2AMEN1HSP90AA1 | |
| SCHEMBL9823684 | 0.79 | CYP3A4 (0.41) | MAPTHDAC1HDAC8HDAC6CYP3A4 | |
| SCHEMBL9391100 | 0.78 | KMT2A (0.47) | MAPTHDAC1HDAC8HDAC6KMT2A | |
| SCHEMBL10361626 | 0.77 | HSP90AA1 (0.49) | MAPTHDAC1HDAC8HDAC6KMT2A | |
| SCHEMBL9746923 | 0.76 | MAPT (0.44) | MAPTHDAC1HDAC8HDAC6CYP3A4 | |
| SCHEMBL10333824 | 0.76 | CYP3A4 (0.36) | MAPTHDAC1HDAC8HDAC6CYP3A4 | |
| SCHEMBL9272650 | 0.76 | CYP3A4 (0.43) | HDAC1HDAC8HDAC6CYP3A4KMT2A | |
| Hydrochloric Acid SCHEMBL10735161 | 0.75 | MAPT (0.43) | MAPTHDAC1HDAC8HDAC6CYP3A4 | |
| SCHEMBL10709771 | 0.74 | MAPT (0.43) | MAPTHDAC1HDAC8HDAC6CYP3A4 | |
| SCHEMBL9795384 | 0.73 | KMT2A (0.47) | MAPTHDAC1HDAC8HDAC6CYP3A4 |
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-1994001418-A1 | TRIAZOLYLBUTANE DERIVATIVES WITH A FUNGICIDAL ACTION | BAYER AKTIENGESELLSCHAFT (DE) | 1994-01-20 | — | — | WO | disclosed |