Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.46 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.46 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.41 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 2/20 | 0.40 |
| ▸ | SLC37A4 | O43826 | 1/20 | 0.39 |
| ▸ | NAAA | Q02083 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 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 | |
|---|---|---|---|---|
| SCHEMBL8093492 | 0.98 | ALDH1A1 (0.46) | ALDH1A1PRSS1PRSS2PRSS3TSHR | |
| SCHEMBL8096633 | 0.94 | ALDH1A1 (0.43) | ALDH1A1PRSS1PRSS2PRSS3TSHR | |
| SCHEMBL8102570 | 0.87 | SMN1; SMN2 (0.42) | ALDH1A1TSHRCYSLTR2CYSLTR1CYP3A4 | |
| SCHEMBL6680902 | 0.86 | ALDH1A1 (0.59) | ALDH1A1PRSS1PRSS2PRSS3TSHR | |
| SCHEMBL23270712 | 0.85 | LMNA (0.52) | ALDH1A1PRSS1PRSS2PRSS3TSHR | |
| SCHEMBL8094356 | 0.85 | ALDH1A1 (0.48) | ALDH1A1PRSS1PRSS2PRSS3TSHR | |
| SCHEMBL6680659 | 0.84 | ALDH1A1 (0.57) | ALDH1A1PRSS1PRSS2PRSS3TSHR | |
| SCHEMBL8098413 | 0.84 | ALDH1A1 (0.38) | ALDH1A1TSHRLMNAMEN1SLC6A3 | |
| SCHEMBL8095848 | 0.84 | PRSS1 (0.45) | ALDH1A1PRSS1PRSS2PRSS3TSHR | |
| SCHEMBL8099853 | 0.83 | ALDH1A1 (0.46) | ALDH1A1PRSS1PRSS2PRSS3TSHR |
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 |