Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.37 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | FOLH1 | Q04609 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8094597 | 0.91 | ALDH1A1 (0.41) | ALDH1A1ALOX15TSHRFOLH1KDM4E | |
| SCHEMBL8098416 | 0.89 | ALDH1A1 (0.44) | ALDH1A1TSHRFOLH1TP53CA2 | |
| SCHEMBL8100828 | 0.88 | ALDH1A1 (0.46) | ALDH1A1TSHRFOLH1KDM4EPOLB | |
| SCHEMBL8094022 | 0.87 | ALDH1A1 (0.40) | ALDH1A1ALOX15TAS1R3TAS1R1TSHR | |
| SCHEMBL2578003 | 0.85 | FOLH1 (0.50) | ALDH1A1ALOX15TSHRFOLH1KDM4E | |
| SCHEMBL29644540 | 0.85 | FOLH1 (0.50) | ALDH1A1ALOX15TSHRFOLH1KDM4E | |
| SCHEMBL8096196 | 0.84 | POLB (0.39) | ALDH1A1TAS1R3TAS1R1TSHRFOLH1 | |
| SCHEMBL8087714 | 0.81 | GABRA1 (0.48) | ALDH1A1ALOX15TSHRFOLH1MEN1 | |
| SCHEMBL27964130 | 0.79 | PRSS1 (0.44) | ALDH1A1TSHRFOLH1 | |
| SCHEMBL7637842 | 0.78 | TSHR (0.39) | TAS1R3TAS1R1TSHRPOLBSLC6A2 |
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-0708077-B1 | Diamino compounds and methods for preparing them | CHISSO CORP (JP) | 2000-12-27 | — | — | EP | disclosed |
| US-5663440-A | Diamino compounds and methods for preparing them | CHISSO CORPORATION (JP) | 1997-09-02 | — | — | US | disclosed |
| EP-0708077-A1 | Diamino compounds and methods for preparing them | CHISSO CORPORATION (JP) | 1996-04-24 | — | — | EP | disclosed |