Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 4/20 | 0.57 |
| ▸ | DHFR | P00374 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | WHR1 | P49842 | 1/20 | 0.47 |
| ▸ | XBP1 | P17861 | 1/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.44 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.44 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.44 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7790975 | 0.90 | ADORA2A (0.51) | ADORA2ADHFRKMT2AKDM4ETP53 | |
| SCHEMBL7799233 | 0.85 | ADORA2A (0.62) | ADORA2ADHFRKMT2AMEN1MAPT | |
| SCHEMBL7790971 | 0.84 | ADORA2A (0.57) | ADORA2ADHFRKMT2AMEN1WHR1 | |
| SCHEMBL7791023 | 0.84 | ADORA2A (0.57) | ADORA2ADHFRKMT2AMEN1WHR1 | |
| SCHEMBL7791033 | 0.84 | ADORA2A (0.61) | ADORA2ADHFRKMT2ATP53MEN1 | |
| SCHEMBL7800422 | 0.84 | ADORA2A (0.57) | ADORA2ADHFRKMT2ATP53MEN1 | |
| SCHEMBL7800398 | 0.82 | ADORA2A (0.55) | ADORA2ADHFRKMT2AKDM4ETP53 | |
| SCHEMBL7799250 | 0.81 | ADORA2A (0.53) | ADORA2ADHFRWHR1EGFRHSP90AA1 | |
| SCHEMBL1257435 | 0.80 | WHR1 (0.71) | ADORA2ADHFRKDM4ENPSR1WHR1 | |
| SCHEMBL30759714 | 0.80 | WHR1 (0.71) | ADORA2ADHFRKDM4ENPSR1WHR1 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109336828-B | Quinazoline derivative and preparation method and application thereof | 雅安职业技术学院 | 2022-04-26 | — | — | CN | disclosed |
| CN-105924433-B | Substituted aminopyrimidine compounds and use method and application thereof | 广东东阳光药业有限公司 | 2020-12-22 | — | — | CN | disclosed |
| CN-104603147-A | Hexadepsipeptide analogues as anticancer compounds | PIRAMAL ENTPR LTD | 2015-05-06 | — | — | CN | disclosed |
| CN-103830662-A | Application of traditional Chinese medicine composition in preparation of drug for inhibiting rheumatoid arthritis angiogenesis | SHIJIAZHUANG YILING PHARMACEUTICAL CO LTD | 2014-06-04 | — | — | CN | disclosed |
| CN-103417907-A | Application of traditional Chinese medicine composition in preparation of medicine for inhibiting angiogenesis | SHIJIAZHUANG YILING PHARMACEUTICAL CO LTD | 2013-12-04 | — | — | CN | disclosed |
| CN-101578279-B | Amide substituted indazoles as poly (ADP ribose) polymerase (PARP) inhibitors | ANGELETTI P IST RICHERCHE BIO | 2013-07-17 | — | — | CN | disclosed |
| CN-101068811-A | Inhibitors of AKT activity | MERCK & CO INC (US) | 2007-11-07 | — | — | CN | disclosed |
| EP-1232146-A1 | 4-(4'-HYDROXYPHENYL)AMINO-6,7-DIMETHOXYQUINAZOLINE TO PREVENT DEVELOPMENT OF COLORECTAL CANCER | Parker Hughes Institute (US) | 2002-08-21 | — | — | EP | disclosed |
| WO-2001036394-A1 | 4-(4'-HYDROXYPHENYL)AMINO-6,7-DIMETHOXYQUINAZOLINE TO PREVENT DEVELOPMENT OF COLORECTAL CANCER | PARKER HUGHES INSTITUTE (US) | 2001-05-25 | — | — | WO | disclosed |
| WO-2001035952-A2 | RADIOSENSITIZATION OF HUMAN GLIOBLASTOMA CELLS BY QUINAZOLINE COMPOUNDS | PARKER HUGUES INSTITUTE (US) | 2001-05-25 | — | — | WO | disclosed |