Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDFT1 | P37268 | 3/20 | 0.47 |
| ▸ | NQO2 | P16083 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | NAMPT | P43490 | 1/20 | 0.42 |
| ▸ | GLI1 | P08151 | 1/20 | 0.42 |
| ▸ | GLI2 | P10070 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5354570 | 0.90 | FDFT1 (0.57) | FDFT1NQO2NAMPTGLI1GLI2 | |
| SCHEMBL21090366 | 0.87 | FDFT1 (0.47) | FDFT1NQO2POLBKDM4ENAMPT | |
| SCHEMBL6202190 | 0.86 | PLAAT3 (0.48) | FDFT1NQO2POLBKDM4ENAMPT | |
| SCHEMBL6202759 | 0.84 | PLAAT3 (0.52) | NQO2POLBCYP3A4KDM4E | |
| SCHEMBL6204512 | 0.83 | FDFT1 (0.43) | FDFT1NQO2POLBKDM4ENAMPT | |
| SCHEMBL21090363 | 0.83 | CYP4F2 (0.49) | FDFT1NQO2CA2AKR1C3 | |
| SCHEMBL6204579 | 0.83 | MTNR1A (0.58) | POLBCA2 | |
| SCHEMBL2024124 | 0.81 | CYP17A1 (0.53) | NQO2CYP3A4KDM4ENAMPTCA2 | |
| SCHEMBL9889553 | 0.80 | EPHX2 (0.52) | NQO2POLBNAMPTCA2 | |
| SCHEMBL29828661 | 0.80 | MTNR1A (0.48) | NQO2POLBNAMPTCA2 |
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 |