Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 14/20 | 0.69 |
| ▸ | HTR1A | P08908 | 2/20 | 0.56 |
| ▸ | HTR1D | P28221 | 2/20 | 0.56 |
| ▸ | HTR1B | P28222 | 2/20 | 0.56 |
| ▸ | HTR2A | P28223 | 2/20 | 0.56 |
| ▸ | HTR7 | P34969 | 2/20 | 0.56 |
| ▸ | HTR2B | P41595 | 2/20 | 0.56 |
| ▸ | HTR5A | P47898 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | PNMT | P11086 | 1/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.50 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL14149435 | 0.89 | SIGMAR1 (0.70) | SIGMAR1HTR1AHTR1DHTR1BHTR2A | |
| SCHEMBL12168011 | 0.87 | SIGMAR1 (0.66) | SIGMAR1HTR1AHTR1DHTR1BHTR2A | |
| SCHEMBL18768914 | 0.83 | CYP1A2 (0.58) | SIGMAR1HTR1AHTR1DHTR1BHTR2A | |
| SCHEMBL429772 | 0.80 | PNMT (0.61) | SIGMAR1CYP1A2CYP2C19CYP2D6PNMT | |
| SCHEMBL23374691 | 0.79 | TAAR1 (0.61) | SIGMAR1HTR1AHTR1DHTR1BHTR2A | |
| SCHEMBL234072 | 0.79 | SIGMAR1 (0.67) | SIGMAR1HTR1AHTR1DHTR1BHTR2A | |
| SCHEMBL11091367 | 0.78 | SIGMAR1 (0.46) | SIGMAR1HTR1AHTR1DHTR1BHTR2A | |
| SCHEMBL3940149 | 0.77 | CYP1A2 (0.60) | SIGMAR1HTR2ACYP1A2CYP2C19CYP2D6 | |
| SCHEMBL4635985 | 0.77 | SIGMAR1 (0.63) | SIGMAR1HTR1AHTR1DHTR1BHTR2A | |
| SCHEMBL9177318 | 0.76 | SIGMAR1 (0.62) | SIGMAR1CYP1A2CYP2C19CYP2D6PNMT |
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 |
|---|---|---|---|---|---|---|---|
| US-4338453-A | Aminoalkyl-1,2,4-triazoles | THE UPJOHN COMPANY (US) | 1982-07-06 | — | — | US | disclosed |