Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | BBOX1 | O75936 | 6/20 | 0.37 |
| ▸ | ADH1A | P07327 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | ADH1C | P00326 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11584430 | 0.96 | THRA (0.40) | THRATHRBBBOX1ADH1ANPSR1 | |
| SCHEMBL9069176 | 0.79 | ALDH1A1 (0.47) | THRATHRBNPSR1GAAALDH1A1 | |
| SCHEMBL8204175 | 0.78 | ALDH1A1 (0.46) | THRATHRBNPSR1GAAALDH1A1 | |
| SCHEMBL11584425 | 0.78 | ALDH1A1 (0.46) | THRATHRBNPSR1GAAALDH1A1 | |
| SCHEMBL8377528 | 0.73 | KMT2A (0.47) | THRATHRBADH1ANPSR1GAA | |
| SCHEMBL4448678 | 0.73 | ALDH1A1 (0.41) | BBOX1NPSR1GAAALDH1A1LMNA | |
| SCHEMBL10170019 | 0.72 | ADH1A (0.39) | THRATHRBADH1AGAAADH1C | |
| Zinc Ion SCHEMBL17337988 | 0.71 | KMT2A (0.36) | ADH1AADH1CALDH1A1CYP2D6CYP2C9 | |
| SCHEMBL14199755 | 0.71 | THRA (0.43) | THRATHRBADH1ANPSR1GAA | |
| SCHEMBL28657065 | 0.69 | ALDH1A1 (0.41) | THRATHRBALDH1A1CYP1A2LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0494956-B1 | AMINOCARBOXYLATE SALTS AS CORROSION INHIBITORS IN COATING APPLICATIONS | COSAN CHEM CORP (US) | 1995-12-13 | — | — | EP | claimed |
| US-6113942-A | Pharmaceutical composition for piperidinoalkanol compounds | AVENTIS PHARMACEUTICALS INC. (US) | 2000-09-05 | — | — | US | disclosed |