Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CASR | P41180 | 11/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1496990 | 0.96 | USP2 (0.37) | ALDH1A1GAALMNATHRBTSHR | |
| SCHEMBL1496915 | 0.96 | USP2 (0.36) | ALDH1A1GAAMAPK1LMNATHRB | |
| SCHEMBL1497027 | 0.94 | ALDH1A1 (0.31) | ALDH1A1GAAMAPK1LMNATHRB | |
| SCHEMBL1496969 | 0.90 | AVPR1A (0.33) | ALDH1A1GAALMNATHRBTSHR | |
| SCHEMBL1496963 | 0.89 | CASR (0.34) | ALDH1A1GAAMAPK1LMNATHRB | |
| SCHEMBL4232503 | 0.89 | HSD17B10 (0.40) | ALDH1A1GAAMAPK1LMNATHRB | |
| SCHEMBL1497024 | 0.89 | TSHR (0.37) | ALDH1A1LMNATHRBTSHRROCK2 | |
| SCHEMBL1484238 | 0.88 | ROCK1 (0.32) | ROCK2ROCK1 | |
| SCHEMBL2386867 | 0.88 | HSD17B10 (0.38) | ALDH1A1GAAMAPK1LMNATHRB | |
| SCHEMBL4228734 | 0.88 | HSD17B10 (0.37) | ALDH1A1GAAMAPK1LMNATHRB |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2292611-A1 | NOVEL THIOPHENEDIAMINE DERIVATIVE HAVING UREA STRUCTURE | Santen Pharmaceutical Co., Ltd (JP) | 2011-03-09 | — | — | EP | disclosed |