Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 6/20 | 0.70 |
| ▸ | HTR1A | P08908 | 4/20 | 0.70 |
| ▸ | HTR2C | P28335 | 3/20 | 0.70 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.70 |
| ▸ | HTR1D | P28221 | 2/20 | 0.70 |
| ▸ | HTR1B | P28222 | 2/20 | 0.70 |
| ▸ | HTR7 | P34969 | 2/20 | 0.70 |
| ▸ | HTR6 | P50406 | 2/20 | 0.70 |
| ▸ | HTR4 | Q13639 | 2/20 | 0.70 |
| ▸ | MAPT | P10636 | 1/20 | 0.70 |
| ▸ | TSHR | P16473 | 1/20 | 0.70 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.70 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.70 |
| ▸ | BLM | P54132 | 1/20 | 0.68 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.68 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.68 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.66 |
| ▸ | HTR2B | P41595 | 3/20 | 0.65 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.64 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.63 |
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 | |
|---|---|---|---|---|
| SCHEMBL9529121 | 0.89 | HTR2A (0.70) | HTR2AHTR1AHTR2CCYP1A2HTR1D | |
| SCHEMBL13602464 | 0.89 | HTR2A (0.69) | HTR2AHTR1AHTR2CCYP1A2HTR1D | |
| Hydrochloric Acid SCHEMBL10491400 | 0.88 | MEN1 (0.71) | HTR2AHTR1AHTR2CCYP1A2HTR1D | |
| SCHEMBL9772989 | 0.83 | HTR2B (0.68) | HTR2AHTR1AHTR2CCYP1A2HTR1D | |
| 5-Methoxytryptamine SCHEMBL29390103 | 0.82 | HTR1A (1.00) | HTR2AHTR1AHTR2CCYP1A2HTR1D | |
| 5-Methoxytryptamine SCHEMBL41982 | 0.82 | HTR1A (1.00) | HTR2AHTR1AHTR2CCYP1A2HTR1D | |
| Hydrochloric Acid SCHEMBL26688721 | 0.82 | BLM (0.63) | HTR2AHTR1AHTR2CCYP1A2HTR1D | |
| SCHEMBL9531949 | 0.81 | HTR2A (0.68) | HTR2AHTR1AHTR2CHTR1DHTR1B | |
| 5-Methoxytryptamine SCHEMBL31109114 | 0.81 | NPSR1 (1.00) | HTR2AHTR1AHTR2CCYP1A2HTR1D | |
| 5-Methoxytryptamine SCHEMBL130877 | 0.81 | HTR1A (0.97) | HTR2AHTR1AHTR2CCYP1A2HTR1D |
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-0287468-B1 | 17-AZA-20,21-DINOREBURNAMENINE DERIVATIVES, PROCESS AND INTERMEDIATES FOR THEIR PREPARATION, THEIR USE AS MEDICAMENTS AND COMPOSITIONS CONTAINING THEM | ROUSSEL-UCLAF (FR) | 1993-03-10 | — | — | EP | disclosed |
| US-4886802-A | ANALGESICS | ROUSSEL UCLAF (FR) | 1989-12-12 | — | — | US | disclosed |
| EP-0287468-A2 | 17-Aza-20,21-dinoreburnamenine derivatives, process and intermediates for their preparation, their use as medicaments and compositions containing them | ROUSSEL-UCLAF (FR) | 1988-10-19 | — | — | EP | disclosed |