Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.49 |
| ▸ | MGLL | Q99685 | 1/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.41 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.40 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.40 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.40 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.40 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | GBA1 | P04062 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5648204 | 0.84 | CYP1A2 (0.51) | CYP19A1CYP2D6 | |
| SCHEMBL19691848 | 0.79 | ALDH1A1 (0.50) | CYP19A1CYP2D6CYP11B1CYP11B2ALDH1A1 | |
| SCHEMBL10543520 | 0.74 | POLB (0.43) | CYP19A1CYP2D6CYP11B1CYP11B2CYP26A1 | |
| SCHEMBL23972322 | 0.73 | SLC6A2 (0.55) | TRPV1MGLLPYCR1PDK1PDK2 | |
| SCHEMBL26027596 | 0.73 | TRPV1 (0.51) | TRPV1MGLLPYCR1ACHESLC6A2 | |
| SCHEMBL15435863 | 0.72 | CYP19A1 (0.49) | MGLLCYP19A1CYP2D6TBXAS1CYP11B1 | |
| SCHEMBL10545302 | 0.72 | PPARG (0.44) | TBXAS1CYP26A1 | |
| SCHEMBL10397484 | 0.72 | PYCR1 (0.50) | TRPV1MGLLPYCR1PDK1ACHE | |
| SCHEMBL20111609 | 0.72 | LIPE (0.48) | CYP2D6ALDH1A1 | |
| SCHEMBL1171099 | 0.71 | AHR (0.42) | TBXAS1ALDH1A1 |
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-4840961-A | FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1989-06-20 | — | — | US | claimed |
| US-4952595-A | FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1990-08-28 | — | — | US | disclosed |
| US-4840961-A | FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1989-06-20 | — | — | US | disclosed |
| EP-0198382-A2 | Heterocyclic amide derivatives | BAYER AG (DE) | 1986-10-22 | — | — | EP | disclosed |