Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | NOS3 | P29474 | 1/20 | 0.41 |
| ▸ | NOS1 | P29475 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | PDE4A | P27815 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1597855 | 0.86 | NOS3 (0.42) | KDM4ECYP3A4TDP1ALDH1A1HPGD | |
| SCHEMBL982469 | 0.85 | NPC1 (0.42) | KDM4ECYP3A4TDP1NOS3NOS1 | |
| SCHEMBL28683997 | 0.83 | PLAU (0.44) | KDM4ETDP1HSD17B10NOS3NOS1 | |
| SCHEMBL11683709 | 0.81 | HTT (0.41) | KDM4ECYP3A4TDP1HPGDLMNA | |
| SCHEMBL10881331 | 0.81 | KDM4E (0.51) | KDM4ECYP3A4TDP1ALOX12ALDH1A1 | |
| SCHEMBL28806916 | 0.81 | KDM4E (0.44) | KDM4ECYP3A4TDP1ALOX12ALDH1A1 | |
| SCHEMBL29094492 | 0.80 | MAPT (0.41) | KDM4ECYP3A4ALDH1A1HPGDHSD17B10 | |
| SCHEMBL4945566 | 0.79 | KDM4E (0.54) | KDM4ECYP3A4TDP1ALOX12ALDH1A1 | |
| SCHEMBL1291161 | 0.79 | L3MBTL1 (0.43) | KDM4ECYP3A4TDP1ALOX12ALDH1A1 | |
| SCHEMBL27670976 | 0.79 | KDM4E (0.43) | KDM4ECYP3A4TDP1ALOX12ALDH1A1 |
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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105130886-A | Preparation method for 4-fluoro-3-methyl-methyl pyridine-2-carboxylate | UNIV HENAN NORMAL | 2015-12-09 | — | — | CN | claimed |
| CN-105061305-A | Method for synthesizing 3-methylpyridine-2-carboxylic acid methyl ester in one step | UNIV HENAN NORMAL | 2015-11-18 | — | — | CN | claimed |
| CN-103864679-B | A kind of preparation method of 3-methyl-2-pyridine carboxylic acid methyl esters | HENAN NORMAL UNIVERSITY (CN) | 2015-11-18 | — | — | CN | claimed |
| CN-103864679-A | Preparation method for 3-methyl-2-pyridinecarboxylate | UNIV HENAN NORMAL | 2014-06-18 | — | — | CN | claimed |
| CN-115181062-A | Preparation method of 6-chloro-3-methyl-2-pyridinecarboxylic acid methyl ester | 八叶草健康产业研究院(厦门)有限公司 | 2022-10-14 | — | — | CN | disclosed |
| CN-109776522-B | Substituted heteroaryl compounds, compositions and uses thereof | 广东东阳光药业有限公司 | 2020-12-29 | — | — | CN | disclosed |
| CN-105130886-A | Preparation method for 4-fluoro-3-methyl-methyl pyridine-2-carboxylate | UNIV HENAN NORMAL | 2015-12-09 | — | — | CN | disclosed |
| CN-103864679-B | A kind of preparation method of 3-methyl-2-pyridine carboxylic acid methyl esters | HENAN NORMAL UNIVERSITY (CN) | 2015-11-18 | — | — | CN | disclosed |
| CN-103864679-B | A kind of preparation method of 3-methyl-2-pyridine carboxylic acid methyl esters | HENAN NORMAL UNIVERSITY (CN) | 2015-11-18 | — | — | CN | disclosed |
| CN-105061305-A | Method for synthesizing 3-methylpyridine-2-carboxylic acid methyl ester in one step | UNIV HENAN NORMAL | 2015-11-18 | — | — | CN | disclosed |
| CN-103864679-B | A kind of preparation method of 3-methyl-2-pyridine carboxylic acid methyl esters | HENAN NORMAL UNIVERSITY (CN) | 2015-11-18 | — | — | CN | disclosed |
| CN-103864679-A | Preparation method for 3-methyl-2-pyridinecarboxylate | UNIV HENAN NORMAL | 2014-06-18 | — | — | CN | disclosed |
| CN-101703507-A | Antineoplastic medicament | UNIV SHANGHAI JIAOTONG | 2010-05-12 | — | — | CN | disclosed |
| CN-101225070-B | Anti-tumor medicine | UNIV SHANGHAI JIAOTONG | 2010-04-14 | — | — | CN | disclosed |
| CN-101553480-A | Helicobacter pylori degerming agent with gastric acid secretion inhibiting effect | ARIGEN PHARMACEUTICALS INC (JP) | 2009-10-07 | — | — | CN | disclosed |
| CN-101400670-A | Novel pyridine derivative having anti-helicobacter pylori activity | ARIGEN INC (JP) | 2009-04-01 | — | — | CN | disclosed |
| EP-1958946-A1 | PYRIDAZINE COMPOUND AND USE THEREOF | Sumitomo Chemical Company, Limited (JP) | 2008-08-20 | — | — | EP | disclosed |
| CN-101225070-A | Anti-tumor medicine | UNIV SHANGHAI JIAOTONG (CN) | 2008-07-23 | — | — | CN | disclosed |
| CN-101052625-A | As P2X7Adamantyl derivatives of receptor antagonists | ASTRAZENECA AB (SE) | 2007-10-10 | — | — | CN | disclosed |
| CN-1882589-A | Novel heterocyclic compounds as HSP 90-inhibitors | CONFORMA THERAPEUTICS CORP (US) | 2006-12-20 | — | — | CN | disclosed |