Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.57 |
| ▸ | GLA | P06280 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13031107 | 0.82 | TSHR (0.57) | ALDH1A1KDM4EGLAGAAHPGD | |
| SCHEMBL18250747 | 0.81 | ALDH1A1 (0.58) | ALDH1A1KDM4EGLAGAAHPGD | |
| SCHEMBL12730328 | 0.80 | KDM4E (0.57) | ALDH1A1KDM4EGLAGAAHPGD | |
| SCHEMBL21310919 | 0.80 | KDM4E (0.57) | ALDH1A1KDM4EGLAGAAHPGD | |
| SCHEMBL26290413 | 0.80 | KDM4E (0.57) | ALDH1A1KDM4EGLAGAAHPGD | |
| SCHEMBL18250330 | 0.80 | KDM4E (0.57) | ALDH1A1KDM4EGLAGAAHPGD | |
| SCHEMBL13662515 | 0.75 | ALDH1A1 (0.52) | ALDH1A1KDM4EGLAGAAHPGD | |
| SCHEMBL21540434 | 0.75 | ALDH1A1 (0.56) | ALDH1A1KDM4EGLAGAAHPGD | |
| SCHEMBL18404644 | 0.72 | GPR3 (0.44) | ALDH1A1KDM4EGLAGAAHPGD | |
| SCHEMBL14164189 | 0.72 | GPR3 (0.44) | ALDH1A1KDM4EGLAGAAHPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009142842-A2 | NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION | INTERMUNE, INC. (US) | 2009-11-26 | — | — | WO | disclosed |