Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1B | Q00975 | 1/20 | 0.56 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.56 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | ADORA2A | P29274 | 9/20 | 0.53 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.53 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.53 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.53 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL3086944 | 0.88 | ADORA3 (0.49) | CACNA1BAPBA1ADORA3MEN1KMT2A | |
| SCHEMBL16628808 | 0.85 | ADORA2A (0.55) | ADORA3MAPTADORA2AADORA1ADORA2B | |
| SCHEMBL16628820 | 0.83 | ADORA3 (0.68) | CACNA1BAPBA1ADORA3MEN1KMT2A | |
| SCHEMBL3089577 | 0.83 | ADORA2A (0.65) | ADORA3ADORA2AADORA1ADORA2B | |
| SCHEMBL3081056 | 0.82 | ADORA2A (0.70) | ADORA3MAPTADORA2AADORA1ADORA2B | |
| SCHEMBL16628837 | 0.81 | ADORA3 (0.58) | ADORA3MEN1KMT2AMAPTADORA2A | |
| SCHEMBL16628794 | 0.81 | ADORA3 (0.58) | ADORA3KMT2AMAPTADORA2AADORA1 | |
| SCHEMBL3087918 | 0.80 | ADORA3 (0.62) | ADORA3ADORA2AADORA1ADORA2BHPGD | |
| SCHEMBL16628795 | 0.79 | ADORA3 (0.66) | ADORA3MEN1KMT2AMAPTADORA2A | |
| SCHEMBL3087954 | 0.79 | ADORA2A (0.66) | ADORA3ADORA2AADORA1ADORA2B |
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 |