Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 8/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | GRN | P28799 | 1/20 | 0.38 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11075842 | 1.00 | CYP3A4 (0.49) | CYP3A4MEN1KMT2ACYP19A1MAPT | |
| SCHEMBL9823725 | 0.82 | CYP3A4 (0.53) | CYP3A4MEN1KMT2ACYP19A1MAPT | |
| SCHEMBL9862847 | 0.82 | CYP3A4 (0.55) | CYP3A4MEN1KMT2ACYP19A1MAPT | |
| SCHEMBL9023287 | 0.80 | CYP3A4 (0.51) | CYP3A4MEN1KMT2ACYP19A1MAPT | |
| SCHEMBL11074019 | 0.78 | MEN1 (0.56) | CYP3A4MEN1KMT2ACYP19A1MAPT | |
| SCHEMBL11074016 | 0.78 | MEN1 (0.56) | CYP3A4MEN1KMT2ACYP19A1MAPT | |
| SCHEMBL5364455 | 0.71 | MAPT (0.77) | CYP3A4MEN1KMT2ACYP19A1MAPT | |
| SCHEMBL10936952 | 0.70 | CYP3A4 (0.69) | CYP3A4MEN1KMT2ACYP19A1MAPT | |
| SCHEMBL10482568 | 0.70 | CYP3A4 (0.64) | CYP3A4MEN1KMT2ACYP19A1MAPT | |
| SCHEMBL10482564 | 0.70 | CYP3A4 (0.64) | CYP3A4MEN1KMT2ACYP19A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0100952-A1 | Substituted azolylallyl ketones and carbinols | BAYER AG (DE) | 1984-02-22 | — | — | EP | disclosed |