Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.40 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.36 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9735470 | 0.89 | KMT2A (0.52) | KMT2AHSP90AA1CYP3A4ALDH1A1CYP2C9 | |
| SCHEMBL9530860 | 0.84 | HSP90AA1 (0.56) | KMT2AHSP90AA1CYP3A4ALDH1A1CYP19A1 | |
| SCHEMBL9530158 | 0.82 | KMT2A (0.50) | KMT2AHSP90AA1CYP3A4ALDH1A1CYP2C9 | |
| SCHEMBL29594737 | 0.82 | KMT2A (0.46) | KMT2AHSP90AA1CYP3A4ALDH1A1PDCD1 | |
| SCHEMBL9532348 | 0.80 | CYP3A4 (0.56) | KMT2AHSP90AA1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL9531219 | 0.79 | KMT2A (0.51) | KMT2AHSP90AA1CYP3A4ALDH1A1CYP2C9 | |
| SCHEMBL15316805 | 0.77 | KMT2A (0.71) | KMT2AHSP90AA1CYP3A4ALDH1A1CYP2C9 | |
| SCHEMBL9529522 | 0.77 | HSP90AA1 (0.56) | KMT2AHSP90AA1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL9529992 | 0.77 | CYP3A4 (0.58) | KMT2AHSP90AA1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL8676792 | 0.76 | HSP90AA1 (0.42) | KMT2AHSP90AA1CYP3A4ALDH1A1CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| US-5786375-A | FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1998-07-28 | — | — | US | disclosed |
| CN-1133590-A | Butenol-triazolyl derivatives, their manufacture and use as microbicides | BAYER AG (DE) | 1996-10-16 | — | — | CN | disclosed |
| EP-0719260-A1 | BUTENOL-TRIAZOLYL DERIVATIVES, THEIR MANUFACTURE AND USE AS MICROBICIDES | BAYER AG (DE) | 1996-07-03 | — | — | EP | disclosed |
| WO-1995007896-A1 | BUTENOL-TRIAZOLYL DERIVATIVES, THEIR MANUFACTURE AND USE AS MICROBICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1995-03-23 | — | — | WO | disclosed |