Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 3/20 | 0.56 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.56 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.56 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 4/20 | 0.52 |
| ▸ | NPC1 | O15118 | 3/20 | 0.52 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 5/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | IKBKB | O14920 | 1/20 | 0.40 |
| ▸ | BRAF | P15056 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9791640 | 0.93 | ADORA2A (0.62) | ADORA2AADORA1ADORA3ADORA2BPOLB | |
| SCHEMBL8490725 | 0.89 | ADORA2A (0.56) | ADORA2AADORA1ADORA3ADORA2BPOLB | |
| SCHEMBL19048700 | 0.81 | ADORA2A (0.72) | ADORA2AADORA1ADORA3ADORA2BPOLB | |
| SCHEMBL28880529 | 0.78 | RAB9A (0.76) | ADORA2AADORA1ADORA3ADORA2BPOLB | |
| SCHEMBL4948820 | 0.77 | ADORA2A (0.42) | ADORA2AADORA1ADORA3ADORA2BPOLB | |
| SCHEMBL31528318 | 0.77 | ADORA2A (0.42) | ADORA2AADORA1ADORA3ADORA2BPOLB | |
| SCHEMBL980050 | 0.75 | MAPT (0.62) | POLBRAB9ANPC1MAPTLMNA | |
| SCHEMBL925865 | 0.75 | HSP90AA1 (0.53) | ADORA2AADORA1ADORA3ADORA2BPOLB | |
| SCHEMBL28814830 | 0.75 | ADORA3 (0.50) | ADORA2AADORA1ADORA3ADORA2BPOLB | |
| SCHEMBL30866250 | 0.73 | MAPT (0.59) | POLBRAB9ANPC1HRH4MAPT |
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-4501689-A | CONTAINING PYRIDINE OR IMIDAZOLE MODIFIED 5-TRIAZINE | TAMURA KAKEN CO., LTD. (JP) | 1985-02-26 | — | — | US | disclosed |