Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.67 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.67 |
| ▸ | HPGD | P15428 | 1/20 | 0.67 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.67 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.58 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.58 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.58 |
| ▸ | PTGER3 | P43115 | 9/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
| ▸ | ALPL | P05186 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL9754413 | 0.85 | PTGER3 (0.56) | ALDH1A1CYP1A2HPGDHSD17B10PTGER3 | |
| SCHEMBL4431905 | 0.83 | KDM4E (0.69) | ALDH1A1CYP1A2HPGDHSD17B10PTGER3 | |
| SCHEMBL12427049 | 0.83 | KDM4E (0.64) | ALDH1A1CYP1A2HPGDHSD17B10SLC6A3 | |
| SCHEMBL4437640 | 0.83 | KDM4E (0.68) | ALDH1A1CYP1A2HPGDHSD17B10SLC6A3 | |
| SCHEMBL9535126 | 0.81 | PTGER3 (0.54) | ALDH1A1CYP1A2HPGDHSD17B10PTGER3 | |
| SCHEMBL4431012 | 0.78 | SLC6A3 (0.58) | ALDH1A1CYP1A2HPGDHSD17B10SLC6A3 | |
| SCHEMBL1547993 | 0.77 | KDM4E (0.55) | ALDH1A1CYP1A2HPGDHSD17B10SLC6A3 | |
| SCHEMBL4428291 | 0.76 | KDM4E (0.48) | ALDH1A1CYP1A2HPGDHSD17B10SLC6A3 | |
| SCHEMBL12427050 | 0.75 | CFTR (0.52) | ALDH1A1CYP1A2HPGDHSD17B10KDM4E | |
| SCHEMBL9535849 | 0.75 | PTGER3 (0.57) | ALDH1A1CYP1A2HPGDHSD17B10SLC6A3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1991017987-A1 | PHENOL AND PYRIDINOL DERIVATIVES AS PHARMACEUTICALS | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1991-11-28 | — | — | WO | claimed |
| EP-2125739-A1 | MODULATORS OF C3A RECEPTOR AND METHODS OF USE THEREOF | ENCYSIVE PHARMACEUTICALS, INC. (US) | 2009-12-02 | — | — | EP | disclosed |
| WO-2008079371-A1 | MODULATORS OF C3A RECEPTOR AND METHODS OF USE THEREOF | ENCYSIVE PHARMACEUTICALS, INC. (US) | 2008-07-03 | — | — | WO | disclosed |
| WO-1991017987-A1 | PHENOL AND PYRIDINOL DERIVATIVES AS PHARMACEUTICALS | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1991-11-28 | — | — | WO | disclosed |