Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 6/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL30107952 | 0.88 | ADORA2A (0.41) | TSHRNPC1HTTRAB9AADORA2A | |
| SCHEMBL30108043 | 0.85 | ADORA2A (0.41) | HTTRAB9AADORA2AADORA1ALDH1A1 | |
| SCHEMBL30107942 | 0.83 | ADORA2A (0.47) | TSHRNPC1HTTRAB9AADORA2A | |
| SCHEMBL30108022 | 0.77 | SLC6A2 (0.37) | ADORA2AADORA1 | |
| SCHEMBL30108012 | 0.73 | TSHR (0.58) | TSHRNPC1HTTRAB9AADORA2A | |
| SCHEMBL30107964 | 0.72 | ADORA2A (0.46) | ADORA2AADORA1ADORA2BADORA3 | |
| SCHEMBL30108063 | 0.72 | KDM4E (0.40) | TSHRNPC1HTTRAB9AADORA2A | |
| SCHEMBL1554000 | 0.69 | MAPT (0.58) | ADORA2AADORA1ALDH1A1HSD17B10KDM4E | |
| SCHEMBL12116702 | 0.67 | ESR2 (0.65) | HTTALDH1A1HSD17B10KDM4EMAPK1 | |
| SCHEMBL5017647 | 0.66 | SMN1; SMN2 (0.54) | TSHRNPC1RAB9AADORA2AADORA1 |
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-2022203399-A1 | ADENOSINE A2A RECEPTOR ANTAGONIST AND USE THEREOF | 주식회사 스탠다임 | 2022-09-29 | — | — | WO | disclosed |