Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.58 |
| ▸ | APP | P05067 | 1/20 | 0.57 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.56 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.56 |
| ▸ | CA1 | P00915 | 1/20 | 0.55 |
| ▸ | CA2 | P00918 | 1/20 | 0.55 |
| ▸ | CA7 | P43166 | 1/20 | 0.55 |
| ▸ | CA9 | Q16790 | 1/20 | 0.55 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | TACR3 | P29371 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL16628820 | 0.88 | ADORA3 (0.68) | ADORA3APPADORA2AADORA1MAPT | |
| SCHEMBL16628733 | 0.86 | ADORA2A (0.59) | ADORA3APPADORA2AADORA1MAPT | |
| SCHEMBL3081056 | 0.85 | ADORA2A (0.70) | ADORA3APPADORA2AADORA1MAPT | |
| SCHEMBL3090422 | 0.84 | ADORA2A (0.65) | ADORA3APPADORA2AADORA1POLB | |
| SCHEMBL16628768 | 0.81 | ADORA2A (0.54) | ADORA3ADORA2AADORA1MAPTKMT2A | |
| SCHEMBL16628738 | 0.81 | ADORA2A (0.59) | ADORA3APPADORA2AADORA1CA1 | |
| SCHEMBL16628751 | 0.81 | CACNA1B (0.56) | ADORA3ADORA2AADORA1MAPTPOLB | |
| SCHEMBL5681767 | 0.80 | RAB9A (0.73) | CA1CA2CA7CA9CA14 | |
| SCHEMBL16628795 | 0.80 | ADORA3 (0.66) | ADORA3APPADORA2AADORA1MAPT | |
| SCHEMBL3093862 | 0.79 | ADORA2A (0.62) | ADORA3APPADORA2AADORA1POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-2164833-B1 | Quinazolinamide derivatives useful for the treatment of tumour diseases | MERCK PATENT GMBH (DE) | 2015-04-15 | — | — | EP | claimed |