Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.73 |
| ▸ | MEN1 | O00255 | 2/20 | 0.73 |
| ▸ | PARP1 | P09874 | 1/20 | 0.52 |
| ▸ | ESR1 | P03372 | 1/20 | 0.51 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.51 |
| ▸ | KCNN4 | O15554 | 4/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.45 |
| ▸ | CES1 | P23141 | 1/20 | 0.45 |
| ▸ | PPARG | P37231 | 1/20 | 0.45 |
| ▸ | PPARA | Q07869 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28147531 | 0.98 | KMT2A (0.70) | KMT2AMEN1PARP1ESR1ESR2 | |
| Methylene Chloride SCHEMBL27910646 | 0.93 | KMT2A (0.63) | KMT2AMEN1PARP1ESR1ESR2 | |
| SCHEMBL5487011 | 0.83 | ESR1 (0.54) | KMT2AMEN1PARP1ESR1ESR2 | |
| SCHEMBL17004183 | 0.82 | ESR1 (0.53) | KMT2AMEN1PARP1ESR1ESR2 | |
| SCHEMBL18697278 | 0.82 | ESR1 (0.53) | KMT2AMEN1PARP1ESR1ESR2 | |
| SCHEMBL5580391 | 0.80 | ESR1 (0.51) | KMT2AMEN1PARP1ESR1ESR2 | |
| SCHEMBL287805 | 0.80 | CYP3A4 (0.63) | KMT2AMEN1ESR1ESR2MAOB | |
| SCHEMBL6987573 | 0.79 | MEN1 (0.50) | KMT2AMEN1PARP1ESR1ESR2 | |
| SCHEMBL442239 | 0.79 | MEN1 (0.52) | KMT2AMEN1PARP1CES2CES1 | |
| SCHEMBL28783426 | 0.78 | KMT2A (0.53) | KMT2AMEN1PARP1ESR1ESR2 |
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 91 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113214339-A | Panaxadiol derivatives, preparation method and medical application thereof | 延边大学 | 2021-08-06 | — | — | CN | claimed |
| CN-106749074-A | A kind of preparation method of Fang oxazolidinones intermediate | 沈阳药科大学 | 2017-05-31 | — | — | CN | claimed |
| CN-105849366-A | Method and composition for hydraulic fracturing and for tracing oil production | 光谱追踪服务有限公司 | 2016-08-10 | — | — | CN | claimed |
| CN-103443099-A | Compositions and methods for modulating FXR | IRM LLC | 2013-12-11 | — | — | CN | claimed |
| CN-102985417-A | Piperidin-4-yl azetidine derivatives as JAK1 inhibitors | INCYTE CORP | 2013-03-20 | — | — | CN | claimed |
| CN-101166733-A | Pyrazole derivatives as phosphodiesterase 4 inhibitors | MEMORY PHARM CORP (US) | 2008-04-23 | — | — | CN | claimed |
| CN-101056628-A | Ester derivatives and medicinal use thereof | JAPAN TOBACCO INC (JP) | 2007-10-17 | — | — | CN | claimed |
| CN-117500786-A | TEAD inhibitors | 奥赖恩公司 | 2024-02-02 | — | — | CN | disclosed |
| CN-113683629-B | Substituted heteroaryl compounds, compositions and uses thereof | 北京范恩柯尔生物科技有限公司 | 2023-07-04 | — | — | CN | disclosed |
| CN-108976222-B | Heterocyclic ring-containing biaryl oxazolidinone compound and preparation method thereof | 沈阳药科大学 | 2021-09-03 | — | — | CN | disclosed |
| CN-113214339-A | Panaxadiol derivatives, preparation method and medical application thereof | 延边大学 | 2021-08-06 | — | — | CN | disclosed |
| CN-105120860-B | Histone deacetylase inhibitors | 生物马林药物股份有限公司 | 2021-01-26 | — | — | CN | disclosed |
| CN-109111451-A | Dihydropyrimidines and its application in drug | 广东东阳光药业有限公司 | 2019-01-01 | — | — | CN | disclosed |
| CN-1646125-A | Substituted pyridones as modulators of P38MAP kinase | PHARMACIA CORP (US) | 2005-07-27 | — | — | CN | disclosed |
| CN-1646426-A | Metallized mesoporous silicate and method of oxidation with the same | SUMITOMO CHEMICAL CO (JP) | 2005-07-27 | — | — | CN | disclosed |
| WO-2004077511-A2 | (METH)ACRYLIC AND (METH)ACRYLAMIDE MONOMERS, POLYMERIZABLE COMPOSITIONS, AND POLYMERS OBTAINED | THE REGENTS OF THE UNIVERSITY OF COLORADO (US) | 2004-09-10 | — | — | WO | disclosed |
| CN-1432014-A | Triazole compound of amide series | SANKYO CO (JP) | 2003-07-23 | — | — | CN | disclosed |
| EP-1062207-A1 | 9-AMINOACRIDINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF | Samjin Pharmaceutical Co., Ltd. (KR) | 2000-12-27 | — | — | EP | disclosed |
| WO-2000037447-A1 | 9-AMINOACRIDINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF | SAMJIN PHARMACEUTICAL CO., LTD. (KR) | 2000-06-29 | — | — | WO | disclosed |
| CN-1152306-A | Process for preparing 5-aryl-2, 4-dialkyl-3H-1, 2, 4-triazole-3-thiones | MERRELL PHARMA INC (US) | 1997-06-18 | — | — | CN | disclosed |