Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.34 |
| ▸ | ACLY | P53396 | 2/20 | 0.34 |
| ▸ | THRA | P10827 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | PLAU | P00749 | 1/20 | 0.33 |
| ▸ | PYGL | P06737 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | EEF2K | O00418 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7965448 | 0.92 | ACLY (0.34) | HSD11B1ALDH1A1KDM4EGAAKMT2A | |
| SCHEMBL8525341 | 0.85 | TDP1 (0.40) | ALDH1A1KDM4EGAAACLYL3MBTL1 | |
| SCHEMBL6622645 | 0.81 | GPR17 (0.36) | ALDH1A1GAAKMT2AMAPTRAB9A | |
| SCHEMBL348786 | 0.75 | CA1 (0.41) | ALDH1A1KDM4EGAAKMT2AACLY | |
| SCHEMBL6622843 | 0.75 | KMT2A (0.49) | ALDH1A1KDM4EGAAKMT2AL3MBTL1 | |
| SCHEMBL5533461 | 0.74 | KMT2A (0.61) | KDM4EKMT2AACLYPLAUCYP2C19 | |
| SCHEMBL6029786 | 0.72 | TUBB1 (0.39) | ALDH1A1KDM4EKMT2AMEN1HPGD | |
| SCHEMBL15754940 | 0.71 | CES2 (0.39) | ALDH1A1GAAKMT2AL3MBTL1MEN1 | |
| SCHEMBL6881746 | 0.70 | KMT2A (0.44) | ALDH1A1KDM4EKMT2ANPC1RAB9A | |
| SCHEMBL6452278 | 0.70 | CES2 (0.40) | ACLYFFAR1FFAR4 |
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 |
|---|---|---|---|---|---|---|---|
| US-6242451-B1 | Fungicidal trihalophenyl-triazolopyrimidines | BASF AKTIENGESELLSCHAFT | 2001-06-05 | — | — | US | disclosed |