Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALML3 | P27482 | 6/20 | 0.45 |
| ▸ | MAOA | P21397 | 4/20 | 0.41 |
| ▸ | MAOB | P27338 | 3/20 | 0.41 |
| ▸ | F10 | P00742 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14261417 | 0.77 | CALML3 (0.52) | CALML3MAOAMAOBF10CYP2C19 | |
| SCHEMBL14261644 | 0.77 | CALML3 (0.52) | CALML3MAOAMAOBF10CYP2C19 | |
| SCHEMBL4728137 | 0.75 | CALML3 (0.45) | CALML3MAOAMAOBF10CYP2C19 | |
| SCHEMBL14261642 | 0.73 | CALML3 (0.43) | CALML3MAOAMAOBF10CYP2C19 | |
| SCHEMBL4727825 | 0.73 | CALML3 (0.43) | CALML3MAOAMAOBF10CYP2C19 | |
| SCHEMBL14261606 | 0.72 | F10 (0.47) | CALML3MAOAMAOBF10CYP2C19 | |
| SCHEMBL4778998 | 0.72 | F10 (0.44) | CALML3MAOAMAOBF10CYP2C19 | |
| SCHEMBL4783429 | 0.72 | F10 (0.44) | CALML3MAOAMAOBF10CYP2C19 | |
| SCHEMBL14261619 | 0.72 | PKM (0.56) | CALML3MAOAMAOBF10CYP2C19 | |
| SCHEMBL4728850 | 0.72 | PKM (0.56) | CALML3MAOAMAOBF10CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009037542-A2 | SPIROCYCLIC COMPOUNDS AS STEAROYL COA DESATURASE INHIBITORS | GLENMARK PHARMACEUTICALS, S.A. (US) | 2009-03-26 | — | — | WO | claimed |