Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 7/20 | 0.49 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.49 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL22957628 | 0.85 | KCNH2 (0.43) | KCNH2ALDH1A1MAOAMAOBTSHR | |
| SCHEMBL2525745 | 0.84 | ALDH1A1 (0.43) | KCNH2ALDH1A1MAOAMAOBTSHR | |
| SCHEMBL14587026 | 0.83 | ALDH1A1 (0.40) | KCNH2ALDH1A1MAOAMAOBTSHR | |
| Hydrochloric Acid SCHEMBL2525743 | 0.82 | ALDH1A1 (0.45) | KCNH2ALDH1A1MAOAMAOBTSHR | |
| SCHEMBL2525936 | 0.75 | FFAR1 (0.46) | KCNH2ALDH1A1MAOAMAOBRAB9A | |
| SCHEMBL26508862 | 0.73 | RAB9A (0.46) | ALDH1A1MAOAMAOBTSHRACHE | |
| SCHEMBL24499264 | 0.73 | NCEH1 (0.43) | KCNH2ALDH1A1MAOAMAOBTSHR | |
| SCHEMBL2290818 | 0.70 | KEAP1 (0.49) | HTR2ASLC6A4KCNH2SLC6A2SLC6A3 | |
| SCHEMBL21494282 | 0.70 | SLC6A4 (0.47) | HTR2ASLC6A4KCNH2SLC6A2SLC6A3 | |
| SCHEMBL3929678 | 0.69 | RAB9A (0.44) | MAOAMAOBTSHRPKMRAB9A |
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-3580220-B1 | AMINOTRIAZOLOPYRIDINES AS KINASE INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2021-11-17 | — | — | EP | disclosed |