Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFKB1 | P19838 | 2/20 | 0.47 |
| ▸ | BLM | P54132 | 4/20 | 0.46 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 4/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.45 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.45 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.45 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.45 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.45 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | APEX1 | P27695 | 3/20 | 0.40 |
| ▸ | RECQL | P46063 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7149154 | 0.79 | ADRA2A (0.47) | NFKB1BLMPMP22ADRA2AADRA1A | |
| SCHEMBL7069616 | 0.70 | ADRA2A (0.53) | NFKB1BLMPMP22ADRA2AADRA1A | |
| SCHEMBL7153411 | 0.69 | ADRA2A (0.56) | NFKB1BLMPMP22ADRA2AADRA1A | |
| SCHEMBL29112412 | 0.69 | ADRA2A (0.56) | NFKB1BLMPMP22ADRA2AADRA1A | |
| SCHEMBL7149473 | 0.69 | ADRA1A (0.65) | NFKB1BLMPMP22ADRA2AADRA1A | |
| SCHEMBL7149085 | 0.69 | ADRA1A (0.70) | NFKB1BLMPMP22ADRA2AADRA1A | |
| SCHEMBL1520565 | 0.68 | ADRA1A (0.54) | NFKB1BLMPMP22ADRA2AADRA1A | |
| SCHEMBL7145406 | 0.68 | ADRA2A (0.39) | NFKB1BLMPMP22ADRA2AADRA1A | |
| SCHEMBL69925 | 0.66 | TDP1 (0.52) | BLMMAPTRECQLTDP1HPGD | |
| SCHEMBL29403778 | 0.66 | TDP1 (0.52) | BLMMAPTRECQLTDP1HPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0040956-B1 | 8-SUBSTITUTED 4-(3,4-DIHYDROXYPHENYL)-1,2,3,4-TETRAHYDROISOQUINOLINES | SMITHKLINE BECKMAN CORPORATION (US) | 1984-10-31 | — | — | EP | disclosed |
| US-4340600-A | Renal dilating methods and compositions using 4-(3,4-dihydroxyphenyl)-1,2,3,4-tetrahydroisoquinolines | SMITHKLINE CORPORATION (US) | 1982-07-20 | — | — | US | disclosed |
| EP-0040956-A1 | 8-Substituted 4-(3,4-dihydroxyphenyl)-1,2,3,4-tetrahydroisoquinolines | SMITHKLINE BECKMAN CORPORATION (US) | 1981-12-02 | — | — | EP | disclosed |