Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 7/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.41 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | CASP3 | P42574 | 1/20 | 0.41 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.41 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.41 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 2/20 | 0.35 |
| ▸ | FGFR1 | P11362 | 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 | |
|---|---|---|---|---|
| SCHEMBL21974830 | 0.83 | CYP2C19 (0.45) | MEN1KMT2ARAB9ANPC1CASP3 | |
| SCHEMBL21974967 | 0.77 | PDE4A (0.45) | MEN1KMT2ARAB9ANPC1CASP3 | |
| SCHEMBL22065281 | 0.75 | MEN1 (0.42) | MEN1KMT2ARAB9ANPC1CASP3 | |
| SCHEMBL21975722 | 0.71 | ROCK2 (0.44) | CYP3A4ROCK2 | |
| SCHEMBL21974929 | 0.69 | ABCG2 (0.41) | MEN1KMT2ARAB9AMAPTCYP2C9 | |
| SCHEMBL24628656 | 0.67 | CASP1 (0.42) | MEN1KMT2ARAB9ANPC1MAPT | |
| SCHEMBL22066248 | 0.66 | MEN1 (0.43) | MEN1KMT2ARAB9ANPC1CASP3 | |
| SCHEMBL21975145 | 0.66 | PDE4A (0.41) | MAPTCYP2C9CYP2C19PDGFRBALDH1A1 | |
| SCHEMBL22065228 | 0.66 | PRKCA (0.46) | MEN1KMT2AGAAEGFRKDR | |
| SCHEMBL21975712 | 0.65 | ALDH1A1 (0.38) | MEN1KMT2ARAB9ANPC1CYP3A4 |
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-3647313-A1 | SUBSTITUTED ARYL ETHER COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND USE THEREOF | Xiamen University (CN) | 2020-05-06 | — | — | EP | disclosed |