Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | GCK | P35557 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9728689 | 0.84 | BCL2 (0.33) | ALDH1A1 | |
| SCHEMBL9728180 | 0.74 | DPP4 (0.42) | ALDH1A1 | |
| SCHEMBL9728690 | 0.73 | XIAP (0.35) | ALDH1A1 | |
| SCHEMBL9702892 | 0.70 | PARP10 (0.43) | ALDH1A1ESR1GCKPARP10 | |
| SCHEMBL9728650 | 0.70 | BCL2 (0.36) | ALDH1A1 | |
| SCHEMBL9704630 | 0.69 | AR (0.38) | ALDH1A1ESR1GCKKDM4EPARP10 | |
| SCHEMBL9728513 | 0.68 | TSHR (0.36) | ALDH1A1KDM4E | |
| SCHEMBL9728307 | 0.67 | TSHR (0.50) | ALDH1A1 | |
| SCHEMBL9728279 | 0.65 | LCK (0.34) | ALDH1A1KDM4E | |
| SCHEMBL9728643 | 0.64 | DPP4 (0.39) | ALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0406163-A1 | Thioxotetrazolines | CIBA-GEIGY AG (CH) | 1991-01-02 | — | — | EP | claimed |
| US-5138068-A | Pesticide | CIBA-GEIGY CORPORATION (US) | 1992-08-11 | — | — | US | disclosed |
| US-5066667-A | Controlling insects and arachnids | CIBA-GEIGY CORPORATION (US) | 1991-11-19 | — | — | US | disclosed |
| EP-0406163-A1 | Thioxotetrazolines | CIBA-GEIGY AG (CH) | 1991-01-02 | — | — | EP | disclosed |