Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 10/20 | 0.57 |
| ▸ | PDE3A | Q14432 | 10/20 | 0.57 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.57 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.57 |
| ▸ | PDE4A | P27815 | 2/20 | 0.53 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.53 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.53 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | PDE5A | O76074 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | BLM | P54132 | 1/20 | 0.53 |
| ▸ | CCNC | P24863 | 1/20 | 0.49 |
| ▸ | CDK8 | P49336 | 1/20 | 0.49 |
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.45 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL24334610 | 0.86 | PDE3B (0.60) | PDE3BPDE3AAURKBINCENPPDE4A | |
| SCHEMBL11229029 | 0.85 | ALK (0.43) | PDE3BPDE3AAURKBINCENPPDE4A | |
| SCHEMBL11227017 | 0.83 | HSD17B1 (0.42) | PDE3BPDE3AAURKBINCENPPDE4A | |
| SCHEMBL11223807 | 0.83 | CDK5 (0.44) | PDE3BPDE3AAURKBINCENPPDE4A | |
| SCHEMBL11234900 | 0.81 | PDE3B (0.61) | PDE3BPDE3AAURKBINCENPPDE4A | |
| SCHEMBL11232569 | 0.81 | CYP46A1 (0.58) | PDE3BPDE3AAURKBINCENPPDE4A | |
| SCHEMBL10704473 | 0.80 | CCNC (0.67) | PDE3BPDE3AAURKBINCENPPDE4A | |
| SCHEMBL11231273 | 0.80 | PDE3B (0.42) | PDE3BPDE3AAURKBINCENPPDE4A | |
| SCHEMBL11228419 | 0.79 | PDE3B (0.50) | PDE3BPDE3AAURKBINCENPPDE4A | |
| SCHEMBL11223228 | 0.78 | PDE3B (0.49) | PDE3BPDE3AAURKBINCENPCYP46A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4339584-A | Process for preparing 3-amino-5-(pyridinyl)-2(1H)-pyridinones via N-hydroxy-1,2-dihydro-2-oxo-5-(pyridinyl)-nicotinimidamide by reaction with polyphosphoric acid | STERLING DRUG INC. (US) | 1982-07-13 | — | — | US | disclosed |
| US-4305948-A | N-Hydroxy-1,2-dihydro-2-oxo-5-(pyridinyl)-nicotinimidamide and their cardiotonic use | STERLING DRUG INC. (US) | 1981-12-15 | — | — | US | disclosed |