Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 4/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.41 |
| ▸ | HTR3A | P46098 | 2/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 3/20 | 0.41 |
| ▸ | MAOA | P21397 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.39 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.38 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 3/20 | 0.37 |
| ▸ | BCHE | P06276 | 2/20 | 0.37 |
| ▸ | F2RL3 | Q96RI0 | 2/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2547192 | 0.86 | MAOB (0.42) | SLC6A2SLC6A4HTR3AKCNH2MAOB | |
| SCHEMBL2547190 | 0.86 | MAOB (0.42) | SLC6A2SLC6A4HTR3AKCNH2MAOB | |
| SCHEMBL14734873 | 0.80 | CA12 (0.41) | SLC6A2SLC6A4HTR3AKCNH2MAOB | |
| SCHEMBL14734872 | 0.80 | MAOB (0.41) | SLC6A2SLC6A4HTR3AKCNH2MAOB | |
| SCHEMBL2552415 | 0.77 | MAOB (0.43) | MAOBMAOAMTNR1A | |
| SCHEMBL2553358 | 0.77 | MAOB (0.41) | SLC6A2SLC6A4HTR3AKCNH2MAOB | |
| SCHEMBL2546225 | 0.77 | MAOB (0.39) | SLC6A2SLC6A4HTR3AKCNH2MAOB | |
| SCHEMBL2546222 | 0.77 | MAOB (0.39) | SLC6A2SLC6A4HTR3AKCNH2MAOB | |
| SCHEMBL2552421 | 0.77 | MAOB (0.43) | MAOBMAOAMTNR1A | |
| SCHEMBL2553357 | 0.77 | MAOB (0.41) | SLC6A2SLC6A4HTR3AKCNH2MAOB |
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-2563765-A1 | BICYCLIC COMPOUND DERIVATIVES AND THEIR USE AS ACC INHIBITORS. | Takeda Pharmaceutical Company Limited (JP) | 2013-03-06 | — | — | EP | disclosed |