Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.46 |
| ▸ | KDM1A | O60341 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | PDE1B | Q01064 | 3/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.41 |
| ▸ | HTR2B | P41595 | 2/20 | 0.40 |
| ▸ | PDE2A | O00408 | 1/20 | 0.40 |
| ▸ | PDE8B | O95263 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | PDE1A | P54750 | 1/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.40 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.40 |
| ▸ | PDE11A | Q9HCR9 | 1/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL15679221 | 0.90 | KDM1A (0.48) | KDM1AMAOAMAOBPDE1BSLC6A4 | |
| SCHEMBL27680731 | 0.84 | TRPM5 (0.47) | KDM1AMAOAMAOBPDE1BSLC6A4 | |
| Alcohol SCHEMBL27680722 | 0.81 | CYP3A4 (0.50) | CYP17A1CYP3A4CYP11B1CYP11B2SLC6A4 | |
| SCHEMBL5709443 | 0.79 | CYP3A4 (0.41) | CYP17A1CYP3A4CYP11B1CYP11B2KDM1A | |
| SCHEMBL5709365 | 0.76 | SRD5A1 (0.45) | CYP17A1CYP3A4CYP11B1CYP11B2KDM1A | |
| SCHEMBL21694952 | 0.76 | PRCP (0.56) | CYP17A1CYP3A4CYP11B1CYP11B2HTR2B | |
| SCHEMBL5709369 | 0.76 | CYP3A4 (0.61) | CYP17A1CYP3A4CYP11B1CYP11B2SLC6A4 | |
| SCHEMBL5709417 | 0.73 | PRCP (0.56) | SLC6A4HTR2BSLC6A2HTR2AHTR2C | |
| SCHEMBL7320995 | 0.71 | — | — | |
| SCHEMBL8887332 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1950328-A | Phenyl indan derivatives | LUNDBECK & CO AS H (DK) | 2007-04-18 | — | — | CN | disclosed |
| 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 |