Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 6/20 | 0.51 |
| ▸ | MAOB | P27338 | 5/20 | 0.51 |
| ▸ | AKT2 | P31751 | 1/20 | 0.45 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | FNTA | P49354 | 1/20 | 0.42 |
| ▸ | FNTB | P49356 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5556671 | 0.89 | MAOB (0.64) | TAAR1MAOBAKT2HCAR2CYP1A2 | |
| SCHEMBL13958745 | 0.88 | TAAR1 (0.61) | TAAR1CYP2A6MAOA | |
| SCHEMBL3786652 | 0.83 | TAAR1 (0.61) | TAAR1MAOBAKT2HDAC8HDAC6 | |
| SCHEMBL13958743 | 0.83 | TAAR1 (0.50) | TAAR1MAOBCYP1A2CYP2A6MAOA | |
| SCHEMBL9658418 | 0.83 | HSD11B1 (0.54) | — | |
| Bromide SCHEMBL28347006 | 0.81 | HSD11B1 (0.53) | — | |
| SCHEMBL2673980 | 0.80 | TAAR1 (0.77) | TAAR1CYP2A6MAOA | |
| SCHEMBL19043262 | 0.79 | MAOB (0.81) | TAAR1MAOBAKT2HCAR2 | |
| SCHEMBL416652 | 0.79 | MAOA (0.64) | TAAR1MAOBAKT2CYP2A6MAOA | |
| SCHEMBL15245000 | 0.79 | AKT2 (0.62) | TAAR1MAOBAKT2CYP1A2CYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3782986-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2021-02-24 | — | — | EP | disclosed |