Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | DHFR | P00374 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | GSK3B | P49841 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | LATS1 | O95835 | 3/20 | 0.35 |
| ▸ | LATS2 | Q9NRM7 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11074069 | 0.82 | GABRP (0.47) | CYP3A4CYP2D6DHFRSMN1; SMN2ALDH1A1 | |
| SCHEMBL11255710 | 0.79 | AAK1 (0.37) | CYP3A4GSK3BS1PR1PDE3BPDE3A | |
| SCHEMBL11176428 | 0.79 | CYP3A4 (0.39) | CYP3A4CYP2D6DHFRSMN1; SMN2ALDH1A1 | |
| SCHEMBL11071690 | 0.79 | ADORA2B (0.42) | ALDH1A1ADORA2BNAAAADORA2AADORA1 | |
| SCHEMBL11164012 | 0.77 | GABRP (0.51) | CYP3A4CYP2D6DHFRSMN1; SMN2ALDH1A1 | |
| SCHEMBL11247476 | 0.77 | PDE3B (0.36) | CYP3A4CYP2D6DHFRSMN1; SMN2ALDH1A1 | |
| SCHEMBL7272491 | 0.75 | DYRK1A (0.47) | CYP3A4CYP2D6SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL11063569 | 0.74 | PDE3B (0.42) | ALDH1A1MAPTPDE3BPDE3AADORA2B | |
| SCHEMBL11069278 | 0.74 | ADORA2B (0.43) | GSK3BADORA2BADORA2AADORA1 | |
| SCHEMBL7280225 | 0.74 | MAPT (0.40) | CYP3A4CYP2D6SMN1; SMN2ALDH1A1MAPT |
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-4351941-A | Pyridinyl-pyridines | STERLING DRUG INC. (US) | 1982-09-28 | — | — | US | disclosed |
| US-4331672-A | 5-(Pyridinyl)pyridine-2-hydrazines, their preparation and their cardiotonic use | STERLING DRUG INC. (US) | 1982-05-25 | — | — | US | disclosed |