Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 1/20 | 0.39 |
| ▸ | CCR5 | P51681 | 1/20 | 0.39 |
| ▸ | CCR8 | P51685 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.36 |
| ▸ | METAP2 | P50579 | 1/20 | 0.34 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.34 |
| ▸ | CSF1R | P07333 | 2/20 | 0.34 |
| ▸ | FLT3 | P36888 | 2/20 | 0.34 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.33 |
| ▸ | CASP7 | P55210 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | PDE9A | O76083 | 1/20 | 0.33 |
| ▸ | PTGES | O14684 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11231370 | 0.76 | PDE3B (0.54) | CCR1CCR5CCR8HDAC6PTGS2 | |
| SCHEMBL11248742 | 0.76 | CCR1 (0.44) | CCR1CCR5CCR8HDAC6PTGS2 | |
| SCHEMBL11239007 | 0.74 | PDE3B (0.58) | KMT2AMAPT | |
| SCHEMBL11240175 | 0.73 | PDE3A (0.57) | CCR1CCR5CCR8HDAC6PTGS2 | |
| SCHEMBL11248993 | 0.73 | GAA (0.50) | CCR1CCR5CCR8HDAC6PTGS2 | |
| SCHEMBL11236627 | 0.72 | CCR1 (0.40) | CCR1CCR5CCR8HDAC6PTGS2 | |
| SCHEMBL11248533 | 0.69 | CCR1 (0.50) | CCR1CCR5CCR8HDAC6PTGS2 | |
| SCHEMBL11242267 | 0.69 | TYRO3 (0.43) | FLT3SMN1; SMN2 | |
| SCHEMBL2674107 | 0.65 | P4HA1 (0.47) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL11242990 | 0.63 | TGFBR1 (0.35) | CCR1CCR8METAP2IRAK4MEN1 |
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-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 |