Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 5/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4724692 | 0.86 | ACHE (0.43) | PCSK9MAPTDRD2ACHEUTS2R | |
| SCHEMBL4766157 | 0.82 | HRH3 (0.45) | ALDH1A1PCSK9DRD2UTS2RHPGD | |
| SCHEMBL4765791 | 0.78 | UTS2R (0.41) | PCSK9DRD2UTS2R | |
| SCHEMBL27566114 | 0.78 | CTSL (0.42) | KDM4EALDH1A1TDP1PCSK9DRD2 | |
| SCHEMBL4519114 | 0.78 | CTSL (0.42) | KDM4EALDH1A1TDP1PCSK9DRD2 | |
| SCHEMBL8173021 | 0.77 | PCSK9 (0.38) | ALDH1A1TDP1PCSK9DRD2MEN1 | |
| SCHEMBL29357542 | 0.76 | NCF1 (0.51) | KDM4EMAPTDRD2MEN1KMT2A | |
| SCHEMBL22455152 | 0.76 | NCF1 (0.51) | KDM4EMAPTDRD2MEN1KMT2A | |
| SCHEMBL4498858 | 0.76 | KDM4E (0.51) | KDM4EALDH1A1SMN1; SMN2TDP1 | |
| SCHEMBL15383665 | 0.76 | KDM4E (0.61) | GPR119KDM4EALDH1A1MAPTACHE |
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-1917262-A1 | PIPERIDINE AND PIPERAZINE DERIVATIVES AS P2X3 ANTAGONISTS | F.HOFFMANN-LA ROCHE AG (CH) | 2008-05-07 | — | — | EP | disclosed |
| WO-2007020194-A1 | PIPERIDINE AND PIPERAZINE DERIVATIVES AS P2X3 ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2007-02-22 | — | — | WO | disclosed |