Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | CCR6 | P51684 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.33 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL30904 | 0.98 | CYP1A2 (0.41) | CYP1A2ALDH1A1LMNAHPGDALOX12 | |
| SCHEMBL1484098 | 0.95 | CYP1A2 (0.40) | CYP1A2ALDH1A1LMNAHPGDALOX12 | |
| Hydrochloric Acid SCHEMBL11788098 | 0.95 | CYP1A2 (0.40) | CYP1A2ALDH1A1LMNAHPGDALOX12 | |
| SCHEMBL2363225 | 0.95 | CYP1A2 (0.40) | CYP1A2ALDH1A1LMNAHPGDALOX12 | |
| SCHEMBL406319 | 0.90 | CYP1A2 (0.45) | CYP1A2ALDH1A1LMNAHPGDALOX12 | |
| Hydrochloric Acid SCHEMBL11628599 | 0.87 | CYP1A2 (0.44) | CYP1A2ALDH1A1LMNAHPGDALOX12 | |
| SCHEMBL325008 | 0.77 | ALDH1A1 (0.41) | CYP1A2ALDH1A1LMNAHPGDALOX12 | |
| SCHEMBL11415997 | 0.73 | ALDH1A1 (0.38) | CYP1A2ALDH1A1LMNAHPGDALOX12 | |
| SCHEMBL5979774 | 0.71 | ABCB11 (0.39) | CYP1A2ALDH1A1TSHRSMN1; SMN2GRIN2D | |
| SCHEMBL15212888 | 0.71 | ALDH1A1 (0.37) | CYP1A2ALDH1A1TSHRSMN1; SMN2GRIN2D |
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 |
|---|---|---|---|---|---|---|---|
| US-4440867-A | Calcined, high surface area, particulate matter, processes using this matter, and admixtures with other agents | ENSOTECH, INC. (US) | 1984-04-03 | — | — | US | claimed |
| EP-3666757-A1 | PROCESS FOR PREPARING A PIPERIDIN-4-ONE | Karl-Franzens-Universität Graz (AT) | 2020-06-17 | — | — | EP | disclosed |
| WO-1998005206-A1 | QUATERNARY AMMONIUM SALT COMPOSITIONS, AND METHODS FOR TREATING SUBSTRATES | HICKSON INTERNATIONAL PLC (US) | 1998-02-12 | — | — | WO | disclosed |