Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 5/20 | 0.35 |
| ▸ | MAOB | P27338 | 3/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
| ▸ | CALML3 | P27482 | 1/20 | 0.30 |
| ▸ | SDHA | P31040 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1393833 | 0.86 | MAOA (0.51) | MAOAMAOBLMNAPTGS1CALML3 | |
| SCHEMBL1393910 | 0.86 | MAOA (0.51) | MAOAMAOBLMNAPTGS1CALML3 | |
| SCHEMBL1393832 | 0.78 | CYP2C19 (0.39) | MAOAMAOBCALML3CYP3A4CYP2C19 | |
| SCHEMBL21555917 | 0.76 | MAOA (0.38) | MAOAMAOBKCNH2LMNAPTGS1 | |
| SCHEMBL21555902 | 0.75 | L3MBTL1 (0.41) | MAOALMNACALML3 | |
| SCHEMBL21555913 | 0.75 | MAOA (0.39) | MAOAMAOBLMNAPTGS1CALML3 | |
| SCHEMBL21555918 | 0.74 | MAOA (0.39) | MAOAMAOBLMNAPTGS1CALML3 | |
| SCHEMBL21555920 | 0.74 | MAOA (0.40) | MAOAMAOBLMNAPTGS1CALML3 | |
| SCHEMBL18403006 | 0.73 | ATM (0.39) | MAOAMAOBLMNAPTGS1CALML3 | |
| SCHEMBL21555919 | 0.72 | MAOA (0.41) | MAOAMAOBKCNH2LMNAPTGS1 |
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-9550783-B2 | Biaryl heterocyclic compounds and methods of making and using the same | MELINTA THERAPEUTICS, INC. (US) | 2017-01-24 | — | — | US | disclosed |