Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | GBA1 | P04062 | 1/20 | 0.46 |
| ▸ | HRH1 | P35367 | 2/20 | 0.42 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.42 |
| ▸ | KDM1A | O60341 | 5/20 | 0.40 |
| ▸ | MAOA | P21397 | 3/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.40 |
| ▸ | MAOB | P27338 | 3/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.40 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.40 |
| ▸ | HTR1B | P28222 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | NSD2 | O96028 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6027572 | 0.86 | SSTR4 (0.47) | GBA1HRH1SOS1KDM1AMAOA | |
| SCHEMBL31336920 | 0.78 | SOS1 (0.47) | LMNACYP2D6GBA1HRH1SOS1 | |
| SCHEMBL9978781 | 0.75 | GBA1 (0.50) | LMNACYP2D6GBA1HRH1SLC6A2 | |
| SCHEMBL5651523 | 0.73 | SLC6A2 (0.50) | LMNACYP2D6GBA1HRH1SLC6A2 | |
| Toluene SCHEMBL28174061 | 0.73 | KDM1A (0.42) | LMNACYP2D6GBA1HRH1SOS1 | |
| SCHEMBL11861949 | 0.72 | HRH1 (0.53) | LMNACYP2D6GBA1HRH1SLC6A2 | |
| SCHEMBL7488409 | 0.72 | GBA1 (0.56) | LMNACYP2D6GBA1HRH1KDM1A | |
| SCHEMBL21214184 | 0.71 | KCNH2 (0.42) | — | |
| Hydrochloric Acid SCHEMBL11843236 | 0.71 | HRH1 (0.51) | LMNACYP2D6GBA1HRH1SLC6A2 | |
| SCHEMBL658055 | 0.70 | GRIN2B (0.62) | GBA1SOS1SLC6A2SLC6A4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1875017-A | Naphthalene-1, 5-disulfonic acid salts of substituted 4-amino-1- (pyridylmethyl) piperidine compounds | THERAVANCE INC (US) | 2006-12-06 | — | — | CN | disclosed |