Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 6/20 | 0.48 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.36 |
| ▸ | KDM1A | O60341 | 2/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | SRD5A1 | P18405 | 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 | |
|---|---|---|---|---|
| SCHEMBL5709351 | 0.87 | BCHE (0.43) | BCHECYP17A1CYP3A4CYP11B2KDM1A | |
| SCHEMBL5709423 | 0.87 | BCHE (0.47) | BCHECYP17A1CYP3A4CYP11B2KDM1A | |
| SCHEMBL5709447 | 0.85 | BCHE (0.42) | BCHECYP17A1CYP3A4CYP11B2KDM1A | |
| SCHEMBL5709461 | 0.77 | BCHE (0.52) | BCHESLC6A4 | |
| SCHEMBL5709418 | 0.77 | BCHE (0.45) | BCHECYP17A1CYP3A4CYP11B2SLC6A4 | |
| SCHEMBL5709355 | 0.77 | BCHE (0.36) | BCHEKDM1ASLC6A4 | |
| SCHEMBL24750180 | 0.76 | BCHE (0.63) | BCHECYP3A4SLC6A4 | |
| SCHEMBL7994246 | 0.75 | BCHE (0.62) | BCHESLC6A4 | |
| SCHEMBL5709439 | 0.70 | SLC6A4 (0.42) | BCHESLC6A4 | |
| SCHEMBL5709388 | 0.70 | BCHE (0.42) | BCHEKDM1ASLC6A4 |
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-1727785-A1 | PHENYL INDAN DERIVATIVES | H.Lundbeck A/S (DK) | 2006-12-06 | — | — | EP | disclosed |
| WO-2005087708-A1 | PHENYL INDAN DERIVATIVES | H. LUNDBECK A/S (DK) | 2005-09-22 | — | — | WO | disclosed |