Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.67 |
| ▸ | TSHR | P16473 | 1/20 | 0.67 |
| ▸ | BLM | P54132 | 1/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.66 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.66 |
| ▸ | USP2 | O75604 | 1/20 | 0.66 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.66 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.66 |
| ▸ | POLB | P06746 | 2/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | GLA | P06280 | 1/20 | 0.59 |
| ▸ | HPGD | P15428 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | MMP13 | P45452 | 1/20 | 0.58 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.56 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | RECQL | P46063 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL21246562 | 0.88 | LMNA (0.63) | CYP1A2CYP3A4TSHRBLMALDH1A1 | |
| SCHEMBL21246581 | 0.87 | ALDH1A1 (0.70) | CYP1A2CYP3A4TSHRBLMALDH1A1 | |
| SCHEMBL21246543 | 0.87 | LMNA (0.61) | CYP1A2CYP3A4TSHRBLMALDH1A1 | |
| SCHEMBL22754565 | 0.87 | LMNA (0.61) | CYP1A2CYP3A4TSHRBLMALDH1A1 | |
| SCHEMBL21246567 | 0.87 | LMNA (0.61) | CYP1A2CYP3A4TSHRBLMALDH1A1 | |
| SCHEMBL21246582 | 0.85 | GAA (0.67) | CYP1A2CYP3A4TSHRBLMALDH1A1 | |
| SCHEMBL22729243 | 0.82 | NAMPT (0.72) | CYP1A2CYP3A4TSHRBLMALDH1A1 | |
| SCHEMBL21246540 | 0.81 | LMNA (0.61) | CYP1A2CYP3A4TSHRBLMALDH1A1 | |
| SCHEMBL21246631 | 0.81 | GAA (0.58) | CYP1A2CYP3A4TSHRBLMALDH1A1 | |
| SCHEMBL21246570 | 0.81 | KMT2A (0.53) | CYP1A2CYP3A4TSHRBLMALDH1A1 |
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-3747866-A1 | BENZAMIDE COMPOUND AND PREPARATION METHOD, USE, AND PHARMACEUTICAL COMPOSITION THEREOF | INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) | 2020-12-09 | — | — | EP | disclosed |
| WO-2019149223-A1 | BENZAMIDE COMPOUND AND PREPARATION METHOD, USE, AND PHARMACEUTICAL COMPOSITION THEREOF | 中国医学科学院药物研究所 | 2019-08-08 | — | — | WO | disclosed |