Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 1/20 | 0.42 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.42 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.38 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.38 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11229029 | 0.84 | ALK (0.43) | PDE3BPDE3ACYP2A6CYP2C19HDAC3 | |
| SCHEMBL11234641 | 0.84 | PDE3B (0.44) | PDE3BPDE3ACYP2E1CYP3A4CYP2A6 | |
| SCHEMBL11231128 | 0.83 | MKNK1 (0.49) | PDE3BPDE3AMKNK1MKNK2KMT2A | |
| SCHEMBL11233016 | 0.80 | PDE3B (0.41) | PDE3BPDE3ACYP2E1CYP3A4CYP2A6 | |
| SCHEMBL11236586 | 0.80 | CDK5 (0.53) | PDE3BPDE3AKDM4EALDH1A1 | |
| SCHEMBL11236041 | 0.80 | PDE3B (0.41) | PDE3BPDE3ACYP3A4CYP2C9MKNK2 | |
| SCHEMBL11235886 | 0.79 | PDE3B (0.46) | PDE3BPDE3ACYP2E1CYP3A4CYP2A6 | |
| SCHEMBL11231551 | 0.79 | AURKB (0.51) | PDE3BPDE3ACYP2E1CYP3A4CYP2A6 | |
| SCHEMBL11230309 | 0.78 | MKNK1 (0.49) | PDE3BPDE3ACYP2E1CYP3A4CYP2A6 | |
| SCHEMBL10707484 | 0.76 | PDE3B (0.73) | PDE3BPDE3ACYP2E1CYP3A4CYP2A6 |
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 |