Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 1/20 | 0.62 |
| ▸ | TTK | P33981 | 1/20 | 0.62 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.62 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.62 |
| ▸ | KMO | O15229 | 2/20 | 0.55 |
| ▸ | MKNK1 | Q9BUB5 | 5/20 | 0.50 |
| ▸ | MKNK2 | Q9HBH9 | 5/20 | 0.50 |
| ▸ | DHODH | Q02127 | 3/20 | 0.47 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.45 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.44 |
| ▸ | PIM1 | P11309 | 1/20 | 0.43 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL10710552 | 0.87 | AURKA (0.65) | AURKATTKAURKBINCENPKMO | |
| SCHEMBL396923 | 0.82 | AURKA (0.58) | AURKATTKAURKBINCENPKMO | |
| SCHEMBL11163292 | 0.81 | TTK (0.58) | AURKATTKAURKBINCENPDYRK1A | |
| SCHEMBL11368332 | 0.77 | TTK (1.00) | AURKATTKAURKBINCENPKMO | |
| SCHEMBL11459818 | 0.77 | AURKA (0.68) | AURKATTKAURKBINCENPKMO | |
| SCHEMBL4853168 | 0.77 | ALDH1A1 (0.58) | KMOMKNK1MKNK2DHODHALDH1A1 | |
| SCHEMBL30977165 | 0.77 | KMO (0.59) | AURKATTKAURKBINCENPKMO | |
| SCHEMBL11458266 | 0.77 | DYRK1A (0.45) | AURKATTKAURKBINCENPDYRK1A | |
| SCHEMBL10843965 | 0.77 | DYRK1A (0.45) | AURKATTKAURKBINCENPKMO | |
| SCHEMBL11614177 | 0.76 | CCNC (0.60) | AURKATTKAURKBINCENPDHODH |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4225715-A | Preparation of 3-amino(or carbamyl)-5-(pyridinyl)-2(1H)-pyridinones | STERLING DRUG INC. (US) | 1980-09-30 | — | — | US | disclosed |
| US-4199586-A | Di-(lower-alkyl) N-[1,2-dihydro-2-oxo-5-(pyridinyl)-3-pyridinyl]amino-methylanemalonates | STERLING DRUG INC. (US) | 1980-04-22 | — | — | US | disclosed |
| US-4137233-A | 1,2-Dihydro-2-oxo-5-(pyridinyl)nicotinamides | STERLING DRUG INC. (US) | 1979-01-30 | — | — | US | disclosed |
| US-4107315-A | 5-(Pyridinyl)-2(1H)-pyridinones | STERLING DRUG INC. (US) | 1978-08-15 | — | — | US | disclosed |
| US-4072746-A | CARDIOTONIC AGENTS | STERLING DRUG INC. (US) | 1978-02-07 | — | — | US | disclosed |
| US-4004012-A | 3-Cyano-5-(pyridinyl)-2(1H)-pyridinones | STERLING DRUG INC. (US) | 1977-01-18 | — | — | US | disclosed |