Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 2/20 | 0.57 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.57 |
| ▸ | CES2 | O00748 | 2/20 | 0.56 |
| ▸ | CES1 | P23141 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 4/20 | 0.46 |
| ▸ | CA2 | P00918 | 4/20 | 0.46 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.44 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.44 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7253116 | 0.87 | CYP11B1 (0.57) | CYP11B1CYP11B2CES2CES1ALDH1A1 | |
| SCHEMBL7253109 | 0.87 | CYP11B1 (0.57) | CYP11B1CYP11B2CES2CES1ALDH1A1 | |
| SCHEMBL7381899 | 0.81 | CES2 (0.52) | CYP11B1CYP11B2CES2CES1ALDH1A1 | |
| SCHEMBL11389643 | 0.81 | CYP11B1 (0.51) | CYP11B1CYP11B2CES2CES1ALDH1A1 | |
| SCHEMBL5471250 | 0.80 | ALDH1A1 (0.54) | CYP11B1CYP11B2CES2CES1ALDH1A1 | |
| SCHEMBL5904302 | 0.80 | CES2 (0.60) | CYP11B1CYP11B2CES2CES1ALDH1A1 | |
| SCHEMBL5904300 | 0.80 | CES2 (0.60) | CYP11B1CYP11B2CES2CES1ALDH1A1 | |
| SCHEMBL11345881 | 0.80 | CES2 (0.50) | CYP11B1CYP11B2CES2CES1ALDH1A1 | |
| SCHEMBL5471251 | 0.80 | ALDH1A1 (0.54) | CYP11B1CYP11B2CES2CES1ALDH1A1 | |
| SCHEMBL9475635 | 0.80 | CYP11B1 (0.58) | CYP11B1CYP11B2CES2CES1ALDH1A1 |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5428045-A | 5-acyl-2-(1H)-pyridinoes | MERRELL DOW PHARMACEUTICALS INC. (US) | 1995-06-27 | — | — | US | disclosed |
| US-5212314-A | Alkoxyimino ether derivatives of 5-acyl-2(1H)-pyridinones | MERRELL DOW PHARMACEUTICALS INC. (US) | 1993-05-18 | — | — | US | disclosed |
| US-5212315-A | Alkoxyimino ether derivatives of 5-acyl-2(1H)-pyridinones | MERRELL DOW PHARMACEUTICALS INC. (US) | 1993-05-18 | — | — | US | disclosed |
| EP-0140375-B1 | ALKOXYIMINO ETHER DERIVATIVES OF 5-ACYL-2(1H)-PYRIDINONES | MERRELL DOW PHARMACEUTICALS INC. (US) | 1992-09-23 | — | — | EP | disclosed |
| US-5118696-A | 5-Acyl-2-(1H)-pyridinones useful for treating cardiac failure | MERRELL DOW PHARMACEUTICALS INC. (US) | 1992-06-02 | — | — | US | disclosed |
| US-5043449-A | Certain alkoxyimino ether derivatives of 5-acyl-2(1H)-pyridinones | MERRELL DOW PHARMACEUTICALS INC. (US) | 1991-08-27 | — | — | US | disclosed |
| US-4992452-A | Certain 5-acyl-2-(1H)-pyridinones useful in treating cardiac failure | MERRELL DOW PHARMACEUTICALS INC. (US) | 1991-02-12 | — | — | US | disclosed |
| US-4920229-A | Novel alkoxyimino ether derivatives of 5-acyl-2(1H)-pyridinones | MERRELL DOW PHARMACEUTICALS INC. (US) | 1990-04-24 | — | — | US | disclosed |
| US-4853395-A | Certain 3-carboxylate or 3-carbamyl-5-acyl-2-(1H)-pyridinones having cardiotonic properties | MERRELL DOW PHARMACEUTICALS INC. (US) | 1989-08-01 | — | — | US | disclosed |
| US-4849522-A | Novel alkoxyimino ether derivatives of 5-acyl-2(1H)-pyridinones | MERRELL DOW PHARMACEUTICALS (US) | 1989-07-18 | — | — | US | disclosed |
| US-4769380-A | Cardiotonic 5-benzoyl-1,2-dihydro-2-oxo-3-pyridinecarboxylates | MERRELL DOW PHARMACEUTICALS INC. (US) | 1988-09-06 | — | — | US | disclosed |
| US-4732982-A | Novel alkoxyimino ether derivatives of 5-acyl-2(1H)-pyridinones | MERRELL DOW PHARMACEUTICALS INC. (US) | 1988-03-22 | — | — | US | disclosed |
| US-4731371-A | Certain 5-acyl-1,2-dihydro-2-oxo-3-pyridinecarbonitriles which are useful as cardiotonic agents | MERRELL DOW PHARMACEUTICALS INC. (US) | 1988-03-15 | — | — | US | disclosed |
| EP-0124090-B1 | 5-ACYL-2-(1H)-PYRIDINONES | MERRELL DOW PHARMACEUTICALS INC. (US) | 1987-04-01 | — | — | EP | disclosed |
| US-4568751-A | 5-Acyl-2-(1H)-pyridinones | MERRELL DOW PHARMACEUTICALS INC. (US) | 1986-02-04 | — | — | US | disclosed |
| EP-0140375-A2 | Alkoxyimino ether derivatives of 5-acyl-2(1H)-pyridinones | MERRELL DOW PHARMACEUTICALS INC. (US) | 1985-05-08 | — | — | EP | disclosed |