Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TBXAS1 | P24557 | 7/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.36 |
| ▸ | ESR1 | P03372 | 2/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.35 |
| ▸ | IDH1 | O75874 | 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 | |
|---|---|---|---|---|
| SCHEMBL11235313 | 1.00 | ALDH1A1 (0.42) | ALDH1A1TBXAS1CYP19A1ESR1BRD4 | |
| SCHEMBL11245034 | 0.84 | ALDH1A1 (0.42) | ALDH1A1TBXAS1CYP19A1ESR1IDH1 | |
| SCHEMBL11245031 | 0.84 | ALDH1A1 (0.42) | ALDH1A1TBXAS1CYP19A1ESR1IDH1 | |
| SCHEMBL11234254 | 0.83 | ALDH1A1 (0.47) | ALDH1A1TBXAS1CYP19A1ESR1CYP11B1 | |
| SCHEMBL11234253 | 0.83 | ALDH1A1 (0.47) | ALDH1A1TBXAS1CYP19A1ESR1CYP11B1 | |
| SCHEMBL11241101 | 0.82 | ALDH1A1 (0.40) | ALDH1A1TBXAS1CYP19A1ESR1IDH1 | |
| SCHEMBL11238270 | 0.82 | ALDH1A1 (0.40) | ALDH1A1TBXAS1CYP19A1ESR1IDH1 | |
| SCHEMBL11241098 | 0.82 | ALDH1A1 (0.40) | ALDH1A1TBXAS1CYP19A1ESR1IDH1 | |
| SCHEMBL11238276 | 0.82 | ALDH1A1 (0.40) | ALDH1A1TBXAS1CYP19A1ESR1IDH1 | |
| SCHEMBL10880435 | 0.76 | TP53 (0.51) | ALDH1A1TBXAS1CYP19A1CYP11B1CYP11B2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4344953-A | INSECTICIDES, NEMATOCIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1982-08-17 | — | — | US | disclosed |
| EP-0005249-B1 | SUBSTITUTED ALKANYL-AZOLYL CARBAMATES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS INSECTICIDES, ACARICIDES AND NEMATOCIDES | BAYER AG (DE) | 1981-09-02 | — | — | EP | disclosed |
| EP-0005249-A2 | Substituted alkanyl-azolyl carbamates, process for their preparation and their use as insecticides, acaricides and nematocides | BAYER AG (DE) | 1979-11-14 | — | — | EP | disclosed |