Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | HTR1A | P08908 | 5/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.48 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.48 |
| ▸ | MPO | P05164 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | NQO2 | P16083 | 1/20 | 0.48 |
| ▸ | HTR2B | P41595 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL9528741 | 0.93 | MTNR1A (0.48) | HTR2AKDM4EHTR1ARAB9ANPC1 | |
| SCHEMBL10491444 | 0.89 | KMT2A (0.51) | HTR2AKDM4EHTR1ARAB9ANPC1 | |
| SCHEMBL9527410 | 0.86 | SLC6A4 (0.44) | HTR2AMAPTKMT2AMTNR1AMTNR1B | |
| SCHEMBL10491382 | 0.82 | KMT2A (0.47) | HTR2AKDM4EHTR1ARAB9ANPC1 | |
| SCHEMBL9531891 | 0.82 | HTR2A (0.43) | HTR2ARAB9AMAPTKMT2AMTNR1A | |
| SCHEMBL9529850 | 0.79 | NPC1 (0.49) | HTR2AKDM4EHTR1ARAB9ANPC1 | |
| Acetic Acid SCHEMBL9532462 | 0.78 | HTR2A (0.56) | HTR2AKDM4EHTR1ARAB9ANPC1 | |
| SCHEMBL10491419 | 0.78 | TSHR (0.43) | HTR2AHTR1ARAB9AALDH1A1MAPT | |
| SCHEMBL30274696 | 0.77 | HTR2A (0.57) | HTR2AKDM4EHTR1ARAB9ANPC1 | |
| SCHEMBL10491380 | 0.75 | SMN1; SMN2 (0.53) | HTR2AKDM4ERAB9ANPC1ALDH1A1 |
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-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 |
| 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 |