Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | TP53 | P04637 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 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 | |
|---|---|---|---|---|
| SCHEMBL27419211 | 0.93 | ALDH1A1 (0.50) | ALDH1A1TP53TSHRMAPTHPGD | |
| SCHEMBL7678921 | 0.90 | ALDH1A1 (0.52) | ALDH1A1TP53TSHRMAPTHPGD | |
| SCHEMBL7590829 | 0.88 | TP53 (0.46) | ALDH1A1TP53TSHRMAPTHPGD | |
| SCHEMBL27538 | 0.88 | TDP1 (0.59) | ALDH1A1TP53TSHRMAPTHPGD | |
| SCHEMBL677583 | 0.88 | TDP1 (0.59) | ALDH1A1TP53TSHRMAPTHPGD | |
| SCHEMBL6060040 | 0.88 | TDP1 (0.59) | ALDH1A1TP53TSHRMAPTHPGD | |
| SCHEMBL16982677 | 0.88 | TDP1 (0.59) | ALDH1A1TP53TSHRMAPTHPGD | |
| SCHEMBL5933073 | 0.88 | TDP1 (0.59) | ALDH1A1TP53TSHRMAPTHPGD | |
| SCHEMBL9840312 | 0.83 | PKM (0.57) | ALDH1A1TP53TSHRMAPTHPGD | |
| SCHEMBL28612378 | 0.81 | TDP1 (0.67) | ALDH1A1TP53TSHRMAPTHPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-0276196-B1 | SUBSTITUTED DIOXOLANE DERIVATIVES | CIBA-GEIGY AG (CH) | 1991-09-18 | — | — | EP | disclosed |
| US-4971981-A | PESTICIDES, INSECTICIDES, LARVICIDES | CIBA-GEIGY CORPORATION (US) | 1990-11-20 | — | — | US | disclosed |
| EP-0276196-A1 | Substituted dioxolane derivatives | CIBA-GEIGY AG (CH) | 1988-07-27 | — | — | EP | disclosed |