Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC7 | O00311 | 9/20 | 0.61 |
| ▸ | PDE3B | Q13370 | 3/20 | 0.59 |
| ▸ | PDE3A | Q14432 | 3/20 | 0.59 |
| ▸ | CCNC | P24863 | 4/20 | 0.48 |
| ▸ | CDK8 | P49336 | 4/20 | 0.48 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.47 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.47 |
| ▸ | BTK | Q06187 | 1/20 | 0.44 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.43 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.43 |
| ▸ | IKBKB | O14920 | 2/20 | 0.42 |
| ▸ | CHUK | O15111 | 1/20 | 0.42 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.42 |
| ▸ | PKMYT1 | Q99640 | 1/20 | 0.42 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.42 |
| ▸ | CDK2 | P24941 | 1/20 | 0.42 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11240589 | 0.90 | PDE3B (0.60) | CDC7PDE3BPDE3ACCNCCDK8 | |
| SCHEMBL11237847 | 0.88 | PDE3B (0.60) | CDC7PDE3BPDE3ACCNCCDK8 | |
| SCHEMBL11246399 | 0.87 | PDE3B (0.52) | CDC7PDE3BPDE3ACCNCCDK8 | |
| SCHEMBL11249495 | 0.86 | PDE3B (0.51) | CDC7PDE3BPDE3ACCNCCDK8 | |
| SCHEMBL11231253 | 0.86 | CDC7 (0.48) | CDC7PDE3BPDE3ACCNCCDK8 | |
| SCHEMBL11231128 | 0.86 | MKNK1 (0.49) | CDC7PDE3BPDE3ABTK | |
| SCHEMBL10996883 | 0.85 | CDC7 (0.43) | CDC7PDE3BPDE3ACDK5CDK5R1 | |
| SCHEMBL11244158 | 0.85 | CCNC (0.49) | CDC7PDE3BPDE3ACCNCCDK8 | |
| SCHEMBL11242652 | 0.83 | CDK5 (0.64) | CDC7PDE3BPDE3ACDK5CDK5R1 | |
| SCHEMBL10704473 | 0.82 | CCNC (0.67) | CDC7PDE3BPDE3ACCNCCDK8 |
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-4313951-A | 3-Substituted-6-(lower-alkyl)-5-(pyridinyl)-2(1H)-pyridinones, their cardiotonic use and intermediates therefor | STERLING DRUG INC. (US) | 1982-02-02 | — | — | US | claimed |
| US-4469871-A | Process for preparing 2-(lower-alkoxy)-1-(pyridinyl) ethenyl lower-alkyl ketones | STERLING DRUG INC. (US) | 1984-09-04 | — | — | US | disclosed |
| EP-0095152-A1 | A process for preparing nicotinonitriles and intermediates used therein | STERLING DRUG INC. (US) | 1983-11-30 | — | — | EP | disclosed |
| US-4417054-A | 2-(Lower-alkoxy)-1-(pyridinyl)ethenyl lower-alkyl ketones | STERLING DRUG INC. (US) | 1983-11-22 | — | — | US | disclosed |
| US-4365065-A | 1-(Pyridinyl)-2-(dimethylamino)ethenyl lower-alkyl ketones | STERLING DRUG INC. (US) | 1982-12-21 | — | — | US | disclosed |
| US-4313951-A | 3-Substituted-6-(lower-alkyl)-5-(pyridinyl)-2(1H)-pyridinones, their cardiotonic use and intermediates therefor | STERLING DRUG INC. (US) | 1982-02-02 | — | — | US | disclosed |