Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 1/20 | 0.50 |
| ▸ | CD44 | P16070 | 1/20 | 0.50 |
| ▸ | MAOB | P27338 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 2/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 5/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL32689446 | 0.82 | TSHR (0.67) | TSHRNPSR1HDAC4HDAC7HDAC5 | |
| SCHEMBL5160890 | 0.82 | TSHR (0.67) | TSHRNPSR1HDAC4HDAC7HDAC5 | |
| SCHEMBL24113114 | 0.74 | TSHR (0.44) | TSHRNPSR1HDAC4HDAC7HDAC5 | |
| SCHEMBL4163569 | 0.73 | TSHR (0.44) | TSHRNPSR1OPRM1F2 | |
| 1,2,3,4-Tetrahydroisoquinoline SCHEMBL6010101 | 0.73 | PNMT (0.79) | PNMTCD44MAOBHTR2C | |
| SCHEMBL4164018 | 0.72 | SMYD3 (0.43) | TSHRNPSR1HDAC4HDAC7HDAC5 | |
| 1,2,3,4-Tetrahydroisoquinoline SCHEMBL4779021 | 0.71 | PNMT (0.76) | PNMTCD44MAOBHTR2C | |
| SCHEMBL27632988 | 0.71 | TSHR (0.50) | TSHRNPSR1 | |
| 1,2,3,4-Tetrahydroisoquinoline SCHEMBL29360217 | 0.71 | PNMT (1.00) | PNMTCD44MAOBHTR2C | |
| 1,2,3,4-Tetrahydroisoquinoline SCHEMBL28236302 | 0.71 | PNMT (1.00) | PNMTCD44MAOBHTR2C |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2274283-A1 | NOVEL N-SUBSTITUTED TETRAHYDROISOQUINOLINE/ISOINDOLINE HYDROXAMIC ACID COMPOUNDS | 4SC AG (DE) | 2011-01-19 | — | — | EP | disclosed |
| WO-2009112550-A1 | NOVEL N-SUBSTITUTED TETRAHYDROISOQUINOLINE/ISOINDOLINE HYDROXAMIC ACID COMPOUNDS | 4SC AG (DE) | 2009-09-17 | — | — | WO | disclosed |