Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 6/20 | 0.39 |
| ▸ | MAOA | P21397 | 4/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | SNCA | P37840 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8718693 | 0.84 | SIGMAR1 (0.43) | SIGMAR1ADRA2BADRA2CADRA1AOPRK1 | |
| SCHEMBL8717109 | 0.84 | SIGMAR1 (0.43) | SIGMAR1ADRA2BADRA2CADRA1AOPRK1 | |
| SCHEMBL8713532 | 0.81 | SIGMAR1 (0.41) | SIGMAR1ADRA2BADRA2CADRA1AOPRK1 | |
| SCHEMBL8430263 | 0.81 | SIGMAR1 (0.50) | SIGMAR1ADRA2BADRA2CADRA1AOPRK1 | |
| SCHEMBL8714022 | 0.79 | SIGMAR1 (0.43) | SIGMAR1ADRA2BADRA2CADRA1AOPRK1 | |
| SCHEMBL8713777 | 0.79 | MAOB (0.43) | SIGMAR1ADRA2BADRA2CADRA1AOPRK1 | |
| SCHEMBL8717096 | 0.78 | NPC1 (0.39) | SIGMAR1ADRA2BADRA2CADRA1AOPRK1 | |
| SCHEMBL8713645 | 0.78 | SIGMAR1 (0.44) | SIGMAR1ADRA2BADRA2CADRA1AOPRK1 | |
| SCHEMBL8714181 | 0.75 | SIGMAR1 (0.40) | SIGMAR1ADRA2BADRA2CADRA1AOPRK1 | |
| SCHEMBL8713177 | 0.75 | SIGMAR1 (0.40) | SIGMAR1ADRA2BADRA2CADRA1AOPRK1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5811293-A | CULTURE PRODUCT AS CHEMICAL INTERMEDIATE FOR ANTI-OBESITY AGENT | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 1998-09-22 | — | — | US | disclosed |