Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 6/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 6/20 | 0.38 |
| ▸ | RELA | Q04206 | 6/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | PTPRB | P23467 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL5722381 | 1.00 | PKM (0.39) | PKMKDM4EALDH1A1RECQLTHRB | |
| SCHEMBL5722372 | 1.00 | PKM (0.39) | PKMKDM4EALDH1A1RECQLTHRB | |
| SCHEMBL5722270 | 0.83 | KDM1A (0.36) | PKMKDM4EALDH1A1RECQLTHRB | |
| SCHEMBL7690716 | 0.83 | KDM1A (0.36) | PKMKDM4EALDH1A1RECQLTHRB | |
| SCHEMBL5726729 | 0.76 | MAOB (0.36) | ALDH1A1NFKB1NFKB2RELAKDM1A | |
| SCHEMBL5726731 | 0.76 | MAOB (0.36) | ALDH1A1NFKB1NFKB2RELAKDM1A | |
| SCHEMBL1988919 | 0.75 | NFKB1 (0.54) | NFKB1NFKB2RELAKDM1AMAOA | |
| SCHEMBL7690260 | 0.72 | NFKB1 (0.39) | ALDH1A1NFKB1NFKB2RELAKDM1A | |
| SCHEMBL5722344 | 0.72 | NFKB1 (0.39) | ALDH1A1NFKB1NFKB2RELAKDM1A | |
| SCHEMBL5722324 | 0.72 | ALDH1A1 (0.38) | ALDH1A1RECQLTHRBNFKB1NFKB2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0933993-B1 | SUBSTITUTED CYCLOPENTANE COMPOUNDS USEFUL AS NEURAMINIDASE INHIBITORS | BIOCRYST PHARM INC (US) | 2006-04-05 | — | — | EP | disclosed |
| US-6410594-B1 | VIRICIDES | BIOCRYST PHARMACEUTICALS, INC. | 2002-06-25 | — | — | US | disclosed |