Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 6/20 | 0.40 |
| ▸ | SLC6A9 | P48067 | 8/20 | 0.39 |
| ▸ | KIF11 | P52732 | 3/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.33 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5709444 | 0.93 | BCHE (0.38) | BCHESLC6A9KIF11KCNH2NR1I2 | |
| SCHEMBL468506 | 0.89 | SLC6A9 (0.43) | BCHESLC6A9KCNH2NR1I2ADRB2 | |
| Hydrochloric Acid SCHEMBL6169128 | 0.88 | SLC6A9 (0.43) | BCHESLC6A9KCNH2NR1I2ADRB2 | |
| Hydrochloric Acid SCHEMBL5709488 | 0.85 | BCHE (0.40) | BCHESLC6A9KIF11KCNH2 | |
| SCHEMBL5709422 | 0.82 | SLC6A9 (0.42) | BCHESLC6A9 | |
| SCHEMBL5709461 | 0.82 | BCHE (0.52) | BCHESLC6A9KIF11SLC6A4 | |
| SCHEMBL5709433 | 0.82 | SLC6A9 (0.47) | BCHESLC6A9 | |
| SCHEMBL5709384 | 0.82 | SLC6A9 (0.47) | BCHESLC6A9 | |
| SCHEMBL5709478 | 0.80 | BCHE (0.42) | BCHESLC6A9 | |
| SCHEMBL5709380 | 0.80 | BCHE (0.36) | BCHEDRD2 |
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 |