Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CTSL | P07711 | 1/20 | 0.40 |
| ▸ | CTSB | P07858 | 1/20 | 0.40 |
| ▸ | CTSS | P25774 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | PLK1 | P53350 | 2/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | NPY1R | P25929 | 1/20 | 0.35 |
| ▸ | NPY2R | P49146 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9984350 | 0.90 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2CTSLCTSBCTSS | |
| SCHEMBL9984484 | 0.90 | ALDH1A1 (0.42) | ALDH1A1SMN1; SMN2RAB9APOLBNPC1 | |
| SCHEMBL9984253 | 0.90 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2CTSLCTSBCTSS | |
| SCHEMBL9984418 | 0.90 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2HTR6RAB9APOLB | |
| SCHEMBL9984026 | 0.85 | RAB9A (0.41) | ALDH1A1SMN1; SMN2HTR6RAB9ANPC1 | |
| SCHEMBL9983969 | 0.82 | HRH4 (0.39) | ALDH1A1HTR6RAB9APOLBNPC1 | |
| SCHEMBL9984326 | 0.82 | HSF1 (0.45) | ALDH1A1SMN1; SMN2CTSLCTSBCTSS | |
| SCHEMBL9984262 | 0.82 | SMN1; SMN2 (0.43) | ALDH1A1SMN1; SMN2RAB9APOLBNPC1 | |
| SCHEMBL9984250 | 0.81 | SMN1; SMN2 (0.43) | ALDH1A1SMN1; SMN2CTSLCTSBCTSS | |
| SCHEMBL9984823 | 0.81 | BRD4 (0.49) | ALDH1A1SMN1; SMN2RAB9ANPC1BRD4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2394993-A2 | NOVEL 2,6-SUBSTITUTED-3-NITROPYRIDINE DERIVATIVE, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION INCLUDING SAME | Dong Wha Pharm. Co., Ltd. (KR) | 2011-12-14 | — | — | EP | disclosed |