Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HNF4A | P41235 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.34 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 3/20 | 0.34 |
| ▸ | GABRB3 | P28472 | 3/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.34 |
| ▸ | GABRA3 | P34903 | 3/20 | 0.34 |
| ▸ | GABRA2 | P47869 | 3/20 | 0.34 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.34 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.34 |
| ▸ | PTPN11 | Q06124 | 2/20 | 0.33 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.33 |
| ▸ | SLC7A11 | Q9UPY5 | 2/20 | 0.33 |
| ▸ | APP | P05067 | 3/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.33 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7729721 | 0.86 | PTPN11 (0.42) | HNF4AGABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL6234156 | 0.80 | HNF4A (0.43) | HNF4ANPC1RAB9AAKR1C2AKR1C1 | |
| SCHEMBL7721881 | 0.80 | HNF4A (0.41) | HNF4AAKR1C2AKR1C1GABRA1GABRG2 | |
| SCHEMBL21856951 | 0.78 | HNF4A (0.45) | HNF4AAKR1C2AKR1C1GABRA1GABRG2 | |
| SCHEMBL16681847 | 0.77 | APP (0.35) | NPC1RAB9AGABRA1GABRG2GABRB3 | |
| SCHEMBL17319633 | 0.77 | APP (0.35) | NPC1RAB9AGABRA1GABRG2GABRB3 | |
| SCHEMBL6233690 | 0.77 | HNF4A (0.38) | HNF4AGABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL672198 | 0.75 | APP (0.36) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL17672806 | 0.74 | ALDH1A1 (0.49) | HNF4ANPC1RAB9AAKR1C2AKR1C1 | |
| SCHEMBL1805369 | 0.74 | KMT2A (0.49) | HNF4AGABRA1GABRG2GABRB3GABRA5 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1080368-B1 | MOLECULAR ROD AND USES | COMMISSARIAT ENERGIE ATOMIQUE (FR) | 2005-05-04 | — | — | EP | disclosed |
| EP-1080368-A1 | MOLECULAR ROD AND USES | COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) | 2001-03-07 | — | — | EP | disclosed |
| WO-1999061912-A1 | MOLECULAR ROD AND USES | COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) | 1999-12-02 | — | — | WO | disclosed |