Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLAAT3 | P53816 | 1/20 | 0.52 |
| ▸ | PLAAT5 | Q96KN8 | 1/20 | 0.52 |
| ▸ | PLAAT2 | Q9NWW9 | 1/20 | 0.52 |
| ▸ | PLAAT4 | Q9UL19 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NQO2 | P16083 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6204512 | 0.87 | FDFT1 (0.43) | PLAAT3PLAAT5PLAAT2PLAAT4POLB | |
| SCHEMBL6202190 | 0.84 | PLAAT3 (0.48) | PLAAT3PLAAT5PLAAT2PLAAT4MAPT | |
| SCHEMBL6203942 | 0.84 | FDFT1 (0.47) | CYP3A4POLBNQO2KDM4E | |
| SCHEMBL5354570 | 0.81 | FDFT1 (0.57) | PLAAT3PLAAT5PLAAT2PLAAT4NQO2 | |
| SCHEMBL21090366 | 0.80 | FDFT1 (0.47) | POLBNQO2KDM4E | |
| SCHEMBL6204579 | 0.78 | MTNR1A (0.58) | ALDH1A1POLBGAA | |
| SCHEMBL67569 | 0.77 | CYP2D6 (0.58) | ALDH1A1NQO2KDM4E | |
| SCHEMBL31506266 | 0.77 | CYP2D6 (0.58) | ALDH1A1NQO2KDM4E | |
| SCHEMBL21090363 | 0.76 | CYP4F2 (0.49) | MAPTKMT2ANQO2 | |
| SCHEMBL6485458 | 0.76 | ROCK1 (0.44) | CYP3A4ALDH1A1MAPTKMT2AGAA |
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-1581498-A2 | PYRIDINYL, PYRIMIDINYL AND PYRAZINYL AMIDES AS POTASSIUM CHANNEL OPENERS | Bristol-Myers Squibb Company (US) | 2005-10-05 | — | — | EP | disclosed |
| WO-2004047739-A2 | PYRIDINYL, PYRIMIDINYL AND PYRAZINYL AMIDES AS POTASSIUM CHANNEL OPENERS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2004-06-10 | — | — | WO | disclosed |