Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | HTR2A | P28223 | 4/20 | 0.33 |
| ▸ | HTR2C | P28335 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | BCHE | P06276 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | RET | P07949 | 1/20 | 0.30 |
| ▸ | HRH1 | P35367 | 1/20 | 0.30 |
| ▸ | CNR2 | P34972 | 3/20 | 0.30 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8215822 | 0.74 | CYP2D6 (0.36) | CYP2D6HTR2AHTR2CALDH1A1CYP1A2 | |
| SCHEMBL3699331 | 0.69 | HTR2A (0.35) | CYP2D6HTR2AHTR2CDRD2SLC6A2 | |
| SCHEMBL7608278 | 0.68 | HTR2A (0.34) | HTR2ADRD2HRH1 | |
| SCHEMBL11503546 | 0.67 | HTR2A (0.35) | HTR2AHTR2CDRD2RETHRH1 | |
| SCHEMBL6241367 | 0.65 | SIGMAR1 (0.44) | CYP2D6DRD2SIGMAR1HTR1ABCHE | |
| SCHEMBL8849849 | 0.64 | HTR2A (0.36) | HTR2AHTR2CALDH1A1HRH1 | |
| SCHEMBL22328101 | 0.64 | HTR2A (0.35) | HTR2AHTR2CRETHRH1 | |
| SCHEMBL22402752 | 0.62 | HTR2A (0.33) | CYP2D6HTR2ACYP2C19BCHEHRH1 | |
| Indene SCHEMBL20636898 | 0.62 | CA1 (0.44) | CYP2D6ALDH1A1CYP1A2CYP2C19SIGMAR1 | |
| SCHEMBL2525691 | 0.61 | HTR2A (0.35) | HTR2AHTR2CALDH1A1RETHRH1 |
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-0848004-B1 | PYRROLIDINE DERIVATIVES HAVING PHOSPHOLIPASE A2 INHIBITORY ACTIVITY | SHIONOGI & CO (JP) | 2003-04-02 | — | — | EP | disclosed |
| US-5955616-A | PROSTAGLANDIN INHIBITORS | SHIONOGI & CO., LTD. (JP) | 1999-09-21 | — | — | US | disclosed |
| EP-0848004-A1 | PYRROLIDINE DERIVATIVES HAVING PHOSPHOLIPASE A2 INHIBITORY ACTIVITY | SHIONOGI & CO., LTD. (JP) | 1998-06-17 | — | — | EP | disclosed |