Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.73 |
| ▸ | LMNA | P02545 | 5/20 | 0.73 |
| ▸ | MAPT | P10636 | 4/20 | 0.73 |
| ▸ | MEN1 | O00255 | 2/20 | 0.73 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.73 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.70 |
| ▸ | HTT | P42858 | 1/20 | 0.67 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | PKM | P14618 | 2/20 | 0.53 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11150916 | 1.00 | ALDH1A1 (0.73) | ALDH1A1LMNAMAPTMEN1KMT2A | |
| SCHEMBL11087066 | 0.83 | CYP19A1 (0.67) | ALDH1A1LMNAMAPTMEN1KMT2A | |
| SCHEMBL11087065 | 0.83 | CYP19A1 (0.67) | ALDH1A1LMNAMAPTMEN1KMT2A | |
| SCHEMBL10946345 | 0.83 | CYP19A1 (0.67) | ALDH1A1LMNAMAPTMEN1KMT2A | |
| SCHEMBL10946350 | 0.83 | CYP19A1 (0.67) | ALDH1A1LMNAMAPTMEN1KMT2A | |
| SCHEMBL8035724 | 0.81 | MAPT (0.71) | ALDH1A1LMNAMAPTMEN1KMT2A | |
| SCHEMBL11298296 | 0.81 | MAPT (0.71) | ALDH1A1LMNAMAPTMEN1KMT2A | |
| SCHEMBL5091820 | 0.81 | MAPT (0.50) | ALDH1A1LMNAMAPTMEN1KMT2A | |
| SCHEMBL11089114 | 0.80 | CYP19A1 (0.62) | ALDH1A1LMNAMAPTMEN1KMT2A | |
| SCHEMBL11089118 | 0.80 | CYP19A1 (0.62) | ALDH1A1LMNAMAPTMEN1KMT2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4435411-A | Combating fungi with 1-phenyl-2-(1,2,4-triazol-1-yl)-prop-2-en-1-ones | BAYER AKTIENGESELLSCHAFT (DE) | 1984-03-06 | — | — | US | disclosed |
| US-4380628-A | REACTING THE KETO-ENAMINE-SUBSTITUTED IMIDAZOLE OR 1,2,4-TRIAZOLE DERIVATIVE WITH A GINR ARD REAGENT; FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1983-04-19 | — | — | US | disclosed |
| EP-0032239-B1 | METHOD FOR PREPARING AZOLYL-VINYL-KETONES | BAYER AG (DE) | 1983-01-12 | — | — | EP | disclosed |
| EP-0040367-A1 | Substituted phenyl-triazolyl-vinyl ketones, process for their preparation and their application as fungicides | BAYER AG (DE) | 1981-11-25 | — | — | EP | disclosed |
| EP-0032239-A1 | Method for preparing azolyl-vinyl-ketones | BAYER AG (DE) | 1981-07-22 | — | — | EP | disclosed |