Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | AKT2 | P31751 | 3/20 | 0.34 |
| ▸ | HTR6 | P50406 | 1/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 2/20 | 0.32 |
| ▸ | AKT1 | P31749 | 1/20 | 0.32 |
| ▸ | AKT3 | Q9Y243 | 1/20 | 0.32 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10972686 | 0.88 | HRH4 (0.43) | AKT2HRH4LMNAMAPTAKT1 | |
| SCHEMBL10970282 | 0.86 | HRH4 (0.43) | NPC1ALDH1A1HRH4LMNAMAPT | |
| SCHEMBL10966667 | 0.86 | HRH4 (0.35) | NPC1HRH4RAB9A | |
| SCHEMBL10969283 | 0.86 | PDE5A (0.38) | NPC1ALDH1A1HRH4RAB9AMAPT | |
| SCHEMBL10663243 | 0.86 | DAPK1 (0.43) | ALDH1A1HRH4LMNA | |
| SCHEMBL10968464 | 0.85 | PDE5A (0.48) | CYP2D6ALDH1A1CYP2C19LMNAMAPT | |
| SCHEMBL10970224 | 0.85 | HRH4 (0.38) | HTR6HRH4LMNA | |
| SCHEMBL10970932 | 0.84 | HRH4 (0.44) | NPC1CYP2D6ALDH1A1CYP2C19HRH4 | |
| SCHEMBL11026067 | 0.83 | NPC1 (0.31) | NPC1CYP2D6ALDH1A1CYP2C19AKT2 | |
| SCHEMBL11044158 | 0.83 | ALDH1A1 (0.36) | ALDH1A1AKT2HRH4LMNAHTR2C |
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-4478833-A | ANTICOAGULANTS | DR. KARL THOMAE GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1984-10-23 | — | — | US | disclosed |