Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 5/20 | 0.83 |
| ▸ | CD44 | P16070 | 2/20 | 0.83 |
| ▸ | MAOB | P27338 | 1/20 | 0.83 |
| ▸ | HTR2C | P28335 | 1/20 | 0.70 |
| ▸ | DRD2 | P14416 | 2/20 | 0.49 |
| ▸ | DRD1 | P21728 | 2/20 | 0.49 |
| ▸ | DRD4 | P21917 | 1/20 | 0.49 |
| ▸ | DRD5 | P21918 | 1/20 | 0.49 |
| ▸ | DRD3 | P35462 | 1/20 | 0.49 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.47 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.47 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.47 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.47 |
| ▸ | PRCP | P42785 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| 1,2,3,4-Tetrahydroisoquinoline SCHEMBL8723566 | 0.98 | PNMT (0.79) | PNMTCD44MAOBHTR2CDRD2 | |
| SCHEMBL23555060 | 0.96 | PNMT (0.83) | PNMTCD44MAOBHTR2CDRD2 | |
| 1,2,3,4-Tetrahydroisoquinoline SCHEMBL27831591 | 0.91 | PNMT (0.91) | PNMTCD44MAOBHTR2CDRD2 | |
| 1,2,3,4-Tetrahydroisoquinoline SCHEMBL28236302 | 0.91 | PNMT (1.00) | PNMTCD44MAOBHTR2CDRD2 | |
| 1,2,3,4-Tetrahydroisoquinoline SCHEMBL29360217 | 0.91 | PNMT (1.00) | PNMTCD44MAOBHTR2CDRD2 | |
| 1,2,3,4-Tetrahydroisoquinoline SCHEMBL19085 | 0.91 | PNMT (1.00) | PNMTCD44MAOBHTR2CDRD2 | |
| SCHEMBL4503618 | 0.89 | CD44 (0.71) | PNMTCD44MAOBHTR2CDRD2 | |
| 1,2,3,4-Tetrahydroisoquinoline SCHEMBL11457582 | 0.89 | PNMT (0.95) | PNMTCD44MAOBHTR2CADRA2A | |
| 1,2,3,4-Tetrahydroisoquinoline SCHEMBL20524019 | 0.89 | PNMT (0.95) | PNMTCD44MAOBHTR2CADRA2A | |
| 1,2,3,4-Tetrahydroisoquinoline SCHEMBL987515 | 0.89 | PNMT (0.95) | PNMTCD44MAOBHTR2CADRA2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112010822-B | Method for preparing chiral gamma-amino alcohol and chiral alpha-allyl alcohol by one-pot method | 南方科技大学 | 2022-11-18 | — | — | CN | disclosed |
| CN-112010822-A | Method for preparing chiral gamma-amino alcohol and chiral alpha-allyl alcohol by one-pot method | 南方科技大学 | 2020-12-01 | — | — | CN | disclosed |
| CN-105777712-B | Tetrahydroisoquinoliderivs derivs and its application | 沈阳药科大学 | 2018-05-22 | — | — | CN | disclosed |
| EP-2861581-B9 | 1,2,3,4-Tetrahydroisoquinoline-pyrrolidine derivatives as antagonists of apoptosis (IAPs) for the treatment of cancer. | BRISTOL MYERS SQUIBB CO (US) | 2017-08-30 | — | — | EP | disclosed |
| EP-2861581-B1 | 1,2,3,4-Tetrahydroisoquinoline-pyrrolidine derivatives as antagonists of apoptosis (IAPs) for the treatment of cancer. | BRISTOL MYERS SQUIBB CO (US) | 2017-02-01 | — | — | EP | disclosed |