Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL16638637 | 0.96 | CYP2C9 (0.41) | CYP2C9CYP2C19MAOAMAOBPAOX | |
| SCHEMBL16638636 | 0.94 | MAOA (0.32) | CYP2C9CYP2C19MAOAMAOBPAOX | |
| SCHEMBL7711651 | 0.92 | CYP2C19 (0.43) | CYP2C9CYP2C19MAOAMAOBPAOX | |
| SCHEMBL16638624 | 0.90 | CYP2C9 (0.42) | CYP2C9CYP2C19MAOAMAOBPAOX | |
| SCHEMBL7711123 | 0.90 | CA12 (0.42) | CYP2C9CYP2C19MAOAMAOBPAOX | |
| SCHEMBL16638614 | 0.89 | CYP2C9 (0.41) | CYP2C9CYP2C19MAOAMAOBPAOX | |
| SCHEMBL10017445 | 0.87 | LCK (0.33) | CYP2C9CYP2C19HDAC6 | |
| SCHEMBL17433040 | 0.86 | LMNA (0.39) | CYP2C9CYP2C19PAOXHDAC6 | |
| SCHEMBL16638615 | 0.85 | LCK (0.32) | — | |
| SCHEMBL16638650 | 0.82 | CYP2C9 (0.42) | CYP2C9CYP2C19PAOXHDAC6 |
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-9006487-B2 | Amine-containing lipids and uses thereof | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2015-04-14 | — | — | US | disclosed |