Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | CRBN | Q96SW2 | 4/20 | 0.45 |
| ▸ | DDB1 | Q16531 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 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 | |
|---|---|---|---|---|
| SCHEMBL9630168 | 0.79 | TDP2 (0.38) | ALDH1A1SMN1; SMN2CRBNPTGS1PTGS2 | |
| SCHEMBL11008299 | 0.79 | SRD5A1 (0.42) | ALDH1A1HPGDSMN1; SMN2CRBNDDB1 | |
| SCHEMBL11079732 | 0.76 | PDE3B (0.49) | CRBNDDB1 | |
| SCHEMBL9722411 | 0.73 | GAA (0.41) | ALDH1A1KDM4ESMN1; SMN2CRBNDDB1 | |
| SCHEMBL9630888 | 0.72 | ALDH1A1 (0.38) | ALDH1A1KDM4EHPGDSMN1; SMN2CRBN | |
| SCHEMBL10338409 | 0.71 | KCNH2 (0.55) | KDM4ECRBNDDB1MEN1KMT2A | |
| SCHEMBL31724043 | 0.69 | KDM4E (0.55) | ALDH1A1KDM4EHPGDSMN1; SMN2CYP1A2 | |
| SCHEMBL10755622 | 0.68 | PDE3B (0.62) | ALDH1A1CYP1A2GAACYP3A4CYP2C9 | |
| SCHEMBL7467815 | 0.68 | KDM4E (0.43) | ALDH1A1KDM4ESMN1; SMN2CYP1A2MAPT | |
| SCHEMBL7450630 | 0.68 | PDE3B (0.61) | CRBNCYP1A2MEN1LMNACYP3A4 |
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-0109628-A1 | 2(1H)-pyridinones and preparation, useful as cardiotonics | STERLING DRUG INC. (US) | 1984-05-30 | — | — | EP | disclosed |
| US-4431651-A | 2-Pyridinones and their use as cardiotonic agents | STERLING DRUG INC. (US) | 1984-02-14 | — | — | US | disclosed |