Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 6/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.43 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.43 |
| ▸ | MC3R | P41968 | 1/20 | 0.43 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.43 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.43 |
| ▸ | GDA | Q9Y2T3 | 1/20 | 0.43 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL23974557 | 0.68 | CYP3A4 (0.37) | ADORA2BADORA2APIK3CDPOLBADORA3 | |
| SCHEMBL4842609 | 0.67 | ADORA2B (0.45) | ADORA2BADORA2APIK3CDPOLBADORA3 | |
| SCHEMBL23473313 | 0.65 | HSD17B10 (0.43) | ADORA2BADORA2APIK3CDPOLBADORA3 | |
| SCHEMBL25462034 | 0.64 | ADORA2A (0.32) | ADORA2AADORA1 | |
| SCHEMBL23607952 | 0.64 | ADORA2B (0.51) | ADORA2BADORA2APIK3CDPOLBADORA3 | |
| SCHEMBL17813498 | 0.64 | CDK4 (0.33) | POLBCYP3A4MAPK1HSD17B10HPGD | |
| SCHEMBL5041971 | 0.62 | ADORA2B (0.33) | ADORA2BADORA2APIK3CDPOLBADORA3 | |
| SCHEMBL17813476 | 0.62 | CDK4 (0.41) | ADORA2BADORA2APIK3CDHSD17B10HPGD | |
| SCHEMBL17813477 | 0.62 | CYP1A2 (0.46) | CYP3A4MAPK1HSD17B10HPGDCYP1A2 | |
| SCHEMBL5039671 | 0.61 | CYP3A4 (0.37) | ADORA2BADORA2APIK3CDPOLBADORA3 |
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-20210344045-A1 | Nonaqueous Electrolyte Solution and Nonaqueous Secondary Battery | ASAHI KASEI KABUSHIKI KAISHA (JP) | 2021-11-04 | — | — | US | disclosed |