Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 4/20 | 0.57 |
| ▸ | XDH | P47989 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | BLM | P54132 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.37 |
| ▸ | CASP7 | P55210 | 1/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6796628 | 0.75 | ADORA2B (0.64) | ADORA2BXDHALDH1A1HSD17B10HPGD | |
| SCHEMBL378879 | 0.73 | ADORA2B (1.00) | ADORA2BXDHALDH1A1HPGDADORA2A | |
| SCHEMBL29600264 | 0.70 | MAPT (0.47) | ADORA2BXDHALDH1A1HSD17B10HPGD | |
| SCHEMBL18036538 | 0.69 | ADORA2B (0.63) | ADORA2BXDHALDH1A1HSD17B10HPGD | |
| Alloxazine SCHEMBL12484288 | 0.69 | BLM (0.62) | ADORA2BALDH1A1HSD17B10ADORA2AKDM4E | |
| SCHEMBL19233007 | 0.68 | KDM4E (0.47) | ALDH1A1HSD17B10HPGDALOX15MAPK1 | |
| SCHEMBL10691998 | 0.66 | ADORA2B (0.42) | ADORA2BALDH1A1HSD17B10HPGDALOX15 | |
| SCHEMBL458284 | 0.66 | SMN1; SMN2 (0.48) | MAPK1KDM4EBLMRAB9ACYP1A2 | |
| SCHEMBL9253425 | 0.66 | ADORA2B (0.59) | ADORA2BALDH1A1HSD17B10HPGDMAPK1 | |
| SCHEMBL23607984 | 0.65 | ADORA2B (0.71) | ADORA2BXDHALDH1A1HPGDMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017137528-A1 | ADENOSINE A1 RECEPTOR AGONIST FOR USE IN TREATMENT OF STATUS EPILEPTICUS | CHARITÉ - UNIVERSITÄTSMEDIZIN BERLIN (DE) | 2017-08-17 | — | — | WO | disclosed |