Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.39 |
| ▸ | ACHE | P22303 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL13904588 | 1.00 | CYP3A4 (0.39) | CYP3A4ACHELMNAALDH1A1KDM4E | |
| SCHEMBL13904860 | 0.80 | HTT (0.46) | CYP3A4ACHELMNAMEN1KMT2A | |
| SCHEMBL21162223 | 0.80 | HTT (0.38) | CYP3A4ACHELMNAALDH1A1KDM4E | |
| SCHEMBL21162218 | 0.78 | KDM4E (0.37) | ACHELMNAALDH1A1KDM4ERAB9A | |
| SCHEMBL22088069 | 0.76 | CYP3A4 (0.44) | CYP3A4ACHELMNAALDH1A1L3MBTL1 | |
| SCHEMBL22088066 | 0.74 | HTT (0.45) | CYP3A4ACHELMNATSHRMEN1 | |
| SCHEMBL15641697 | 0.73 | PAX8 (0.38) | CYP3A4ALDH1A1KDM4ERAB9APAX8 | |
| SCHEMBL21162145 | 0.73 | PAX8 (0.48) | CYP3A4ACHELMNAALDH1A1KDM4E | |
| SCHEMBL22088551 | 0.73 | PAX8 (0.48) | CYP3A4ACHELMNAALDH1A1KDM4E | |
| SCHEMBL22088138 | 0.73 | PAX8 (0.48) | CYP3A4ACHELMNAALDH1A1KDM4E |
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-2009026961-A1 | PROCESSES FOR THE PREPARATION OF PANCRATISTATIN AND PANCRATISTATIN ANALOGUES | UNIVERSIDAD DE SANTIAGO DE COMPOSTELA (ES) | 2009-03-05 | — | — | WO | disclosed |