Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 1/20 | 0.45 |
| ▸ | DHFR | P00374 | 1/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.43 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.43 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | NEK2 | P51955 | 1/20 | 0.41 |
| ▸ | WHR1 | P49842 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | PIK3CD | O00329 | 3/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.40 |
| ▸ | PIK3CB | P42338 | 3/20 | 0.40 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL182822 | 0.91 | CHEK2 (0.53) | ADORA1DHFRADORA2ACHEK1CHEK2 | |
| SCHEMBL182850 | 0.85 | DHFR (0.53) | ADORA1DHFRADORA2AHSP90AB1L3MBTL1 | |
| SCHEMBL1883143 | 0.83 | MAPT (0.51) | ADORA1DHFRADORA2AL3MBTL1KDM4E | |
| SCHEMBL182897 | 0.81 | ADORA1 (0.48) | ADORA1DHFRADORA2AHSP90AB1L3MBTL1 | |
| SCHEMBL188522 | 0.81 | DHODH (0.52) | ADORA1DHFRADORA2AL3MBTL1NEK2 | |
| SCHEMBL182575 | 0.81 | ADORA1 (0.52) | ADORA1DHFRADORA2AHSP90AB1L3MBTL1 | |
| SCHEMBL183022 | 0.80 | SQSTM1 (0.48) | ADORA1DHFRADORA2AHSP90AB1L3MBTL1 | |
| SCHEMBL182874 | 0.79 | PDGFRB (0.48) | ADORA1DHFRADORA2AHSP90AB1L3MBTL1 | |
| SCHEMBL183072 | 0.78 | FYN (0.54) | ADORA1DHFRADORA2AL3MBTL1PIK3CD | |
| SCHEMBL182810 | 0.77 | PIK3CA (0.49) | ADORA1DHFRADORA2AHSP90AB1L3MBTL1 |
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-2049502-B1 | 2,4-SUBSTITUTED QUINAZOLINES AS LIPID KINASE INHIBITORS | NOVARTIS AG (CH) | 2012-01-04 | — | — | EP | claimed |