Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.63 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.63 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.63 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.63 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.62 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.57 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.57 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.57 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.57 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.57 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.57 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.57 |
| ▸ | CCKBR | P32239 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 2/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.56 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.56 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.56 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.56 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL3249926 | 0.85 | NR1I2 (0.74) | HDAC3HDAC1HDAC8HDAC6NPSR1 | |
| SCHEMBL9380657 | 0.83 | HDAC3 (0.69) | HDAC3HDAC1HDAC8HDAC6NPSR1 | |
| SCHEMBL8851595 | 0.81 | GABRA1 (0.68) | HDAC3HDAC1HDAC8HDAC6NPSR1 | |
| SCHEMBL1368126 | 0.80 | HDAC3 (0.78) | HDAC3HDAC1HDAC8HDAC6NPSR1 | |
| SCHEMBL6985755 | 0.79 | GABRA1 (0.65) | HDAC3HDAC1HDAC8HDAC6NPSR1 | |
| SCHEMBL7541208 | 0.78 | GABRA1 (0.68) | HDAC3HDAC1HDAC8HDAC6NPSR1 | |
| SCHEMBL27562818 | 0.77 | NPSR1 (0.78) | HDAC3HDAC1HDAC8HDAC6NPSR1 | |
| SCHEMBL11576361 | 0.77 | GABRA1 (0.62) | HDAC3HDAC1HDAC8HDAC6NPSR1 | |
| SCHEMBL4414577 | 0.77 | GABRP (0.59) | HDAC3HDAC1HDAC8HDAC6GABRA1 | |
| SCHEMBL1367380 | 0.77 | HDAC3 (0.98) | HDAC3HDAC1HDAC8HDAC6 |
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-1089981-A1 | COMPOUNDS FOR INHIBITING BETA-AMYLOID PEPTIDE RELEASE AND/OR ITS SYNTHESIS. | Elan Pharmaceuticals, Inc. (US) | 2001-04-11 | — | — | EP | disclosed |
| WO-1999067220-A1 | COMPOUNDS FOR INHIBITING BETA-AMYLOID PEPTIDE RELEASE AND/OR ITS SYNTHESIS | ELAN PHARMACEUTICALS, INC. (US) | 1999-12-29 | — | — | WO | disclosed |