Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 3/20 | 0.56 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.56 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.56 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.56 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.56 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.56 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.56 |
| ▸ | HTR2A | P28223 | 1/20 | 0.56 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.56 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.53 |
| ▸ | MAOB | P27338 | 6/20 | 0.50 |
| ▸ | MAOA | P21397 | 5/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.50 |
| ▸ | SNCA | P37840 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL14008049 | 1.00 | SLC6A2 (0.56) | SLC6A2ADRA2BADRA2CADRA1AOPRK1 | |
| SCHEMBL14008050 | 1.00 | SLC6A2 (0.56) | SLC6A2ADRA2BADRA2CADRA1AOPRK1 | |
| SCHEMBL10012545 | 0.82 | SLC6A2 (0.53) | SLC6A2ADRA2BADRA2CADRA1AOPRK1 | |
| SCHEMBL7430245 | 0.81 | SLC6A2 (0.52) | SLC6A2ADRA2BADRA2CADRA1AOPRK1 | |
| SCHEMBL28757752 | 0.79 | TAAR1 (0.48) | SLC6A2ADRA2BADRA2CADRA1AOPRK1 | |
| SCHEMBL8531718 | 0.79 | ADRA2B (0.50) | SLC6A2ADRA2BADRA2CADRA1AOPRK1 | |
| SCHEMBL19285766 | 0.77 | MAOB (0.69) | SLC6A2ADRA2BADRA2CADRA1AOPRK1 | |
| Dimetamfetamine SCHEMBL2110135 | 0.77 | SLC6A4 (0.67) | SLC6A2ADRA2BADRA2CADRA1AOPRK1 | |
| Dimetamfetamine SCHEMBL12203605 | 0.77 | SLC6A4 (0.67) | SLC6A2ADRA2BADRA2CADRA1AOPRK1 | |
| Dimetamfetamine SCHEMBL727641 | 0.77 | SLC6A4 (0.67) | SLC6A2ADRA2BADRA2CADRA1AOPRK1 |
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-3464297-B1 | PROCESS FOR PREPARATION OF ERIBULIN AND INTERMEDIATES THEREOF | Dr Reddys Laboratories Ltd (IN) | 2023-10-25 | — | — | EP | disclosed |
| WO-2017203459-A1 | PROCESS FOR PREPARATION OF ERIBULIN AND INTERMEDIATES THEREOF | DR. REDDY'S LABORATORIES LIMITED (IN) | 2017-11-30 | — | — | WO | disclosed |