Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 11/20 | 0.68 |
| ▸ | LMNA | P02545 | 4/20 | 0.68 |
| ▸ | MAPT | P10636 | 1/20 | 0.68 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.62 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.61 |
| ▸ | POLB | P06746 | 2/20 | 0.60 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.60 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.60 |
| ▸ | CNR1 | P21554 | 1/20 | 0.60 |
| ▸ | ACHE | P22303 | 1/20 | 0.60 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.60 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.60 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.60 |
| ▸ | MC3R | P41968 | 1/20 | 0.60 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.60 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.60 |
| ▸ | GDA | Q9Y2T3 | 1/20 | 0.60 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.60 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL11381846 | 0.94 | ADORA2B (0.64) | ADORA2BLMNAMAPTSMN1; SMN2RXFP1 | |
| SCHEMBL23974589 | 0.89 | ADORA2B (0.66) | ADORA2BLMNAMAPTSMN1; SMN2RXFP1 | |
| SCHEMBL16120984 | 0.86 | ADORA2B (0.81) | ADORA2BLMNAMAPTSMN1; SMN2RXFP1 | |
| SCHEMBL19533057 | 0.85 | ADORA2B (0.73) | ADORA2BLMNAMAPTSMN1; SMN2RXFP1 | |
| SCHEMBL6310598 | 0.84 | ADORA2B (0.72) | ADORA2BLMNAMAPTSMN1; SMN2RXFP1 | |
| SCHEMBL19370573 | 0.83 | ADORA2B (0.71) | ADORA2BLMNAMAPTSMN1; SMN2RXFP1 | |
| SCHEMBL16120975 | 0.83 | ADORA2B (0.88) | ADORA2BLMNAMAPTSMN1; SMN2RXFP1 | |
| SCHEMBL516014 | 0.83 | ADORA2B (0.72) | ADORA2BLMNAMAPTSMN1; SMN2RXFP1 | |
| SCHEMBL16120979 | 0.83 | ADORA2B (0.85) | ADORA2BLMNAMAPTSMN1; SMN2RXFP1 | |
| Etamiphyllin SCHEMBL355304 | 0.83 | ADORA2B (0.67) | ADORA2BLMNAMAPTSMN1; SMN2RXFP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9764872-B2 | Gas barrier enhancing additives and methods | THE COCA-COLA COMPANY (US) | 2017-09-19 | — | — | US | disclosed |
| US-20160031583-A1 | GAS BARRIER ENHANCING ADDITIVES AND METHODS | CSPC INNOVATION PHARMACEUTICAL CO., LTD. (CN) | 2016-02-04 | — | — | US | disclosed |