Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 2/20 | 0.63 |
| ▸ | DHFR | P00374 | 7/20 | 0.57 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.47 |
| ▸ | P2RX2 | Q9UBL9 | 1/20 | 0.47 |
| ▸ | TDO2 | P48775 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.44 |
| ▸ | USP7 | Q93009 | 1/20 | 0.43 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.42 |
| ▸ | CDK2 | P24941 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL30488033 | 1.00 | ADORA1 (0.63) | ADORA1DHFRP2RX3P2RX2TDO2 | |
| SCHEMBL31612551 | 0.84 | DHFR (0.61) | ADORA1DHFRKMT2AADORA2A | |
| SCHEMBL29116207 | 0.84 | DHFR (0.61) | ADORA1DHFRKMT2AADORA2A | |
| SCHEMBL29913206 | 0.81 | DHFR (0.67) | DHFRTDO2KMT2AMAP4K4 | |
| SCHEMBL1936800 | 0.81 | DHFR (0.57) | ADORA1DHFRKMT2AADORA2A | |
| SCHEMBL736022 | 0.81 | DHFR (0.58) | ADORA1DHFRKMT2AADORA2AUSP7 | |
| SCHEMBL4613214 | 0.81 | DHFR (0.53) | ADORA1DHFR | |
| SCHEMBL1388506 | 0.81 | DHFR (0.67) | DHFRTDO2KMT2AMAP4K4 | |
| SCHEMBL29655508 | 0.80 | DHFR (0.55) | ADORA1DHFRADORA2AMAP4K4 | |
| SCHEMBL1388289 | 0.80 | DHFR (0.55) | ADORA1DHFRADORA2AMAP4K4 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012115479-A2 | DIAMINOPYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF | YUHAN CORPORATION (KR) | 2012-08-30 | — | — | WO | claimed |
| CN-113061116-A | Aminopyrimidine compound, preparation method, composition and application thereof | 上海医药工业研究院 | 2021-07-02 | — | — | CN | disclosed |
| CN-110467638-A | A kind of double amino Chloropyrimide class compounds containing m-chloroaniline class substituent group, preparation method and applications | BEIJING SAITE MINGQIANG MEDICINE TECH CO LTD | 2019-11-19 | — | — | CN | disclosed |
| WO-2012115479-A2 | DIAMINOPYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF | YUHAN CORPORATION (KR) | 2012-08-30 | — | — | WO | disclosed |
| EP-1981856-A2 | PYRIMIDINE DERIVATIVES | AstraZeneca AB (SE) | 2008-10-22 | — | — | EP | disclosed |
| WO-2007085833-A2 | PYRIMIDINE DERIVATIVES | ASTRAZENECA AB (SE) | 2007-08-02 | — | — | WO | disclosed |
| EP-0674627-A1 | PYRIMIDINE, PYRIDINE, PTERIDINONE AND INDAZOLE DERIVATIVES AS ENZYME INHIBITORS | THE WELLCOME FOUNDATION LIMITED (GB) | 1995-10-04 | — | — | EP | disclosed |
| WO-1994014780-A1 | PYRIMIDINE, PYRIDINE, PTERIDINONE AND INDAZOLE DERIVATIVES AS ENZYME INHIBITORS | THE WELLCOME FOUNDATION LIMITED (GB) | 1994-07-07 | — | — | WO | disclosed |