Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.66 |
| ▸ | GABBR2 | O75899 | 2/20 | 0.52 |
| ▸ | GABBR1 | Q9UBS5 | 2/20 | 0.52 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.50 |
| ▸ | HTR2A | P28223 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.44 |
| ▸ | DRD3 | P35462 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | EDNRB | P24530 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | MC4R | P32245 | 1/20 | 0.44 |
| ▸ | MC3R | P41968 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL12323888 | 1.00 | EPHX1 (0.66) | EPHX1GABBR2GABBR1TAAR1HTR2A | |
| Hydrochloric Acid SCHEMBL27505701 | 0.98 | EPHX1 (0.63) | EPHX1GABBR2GABBR1TAAR1HTR2A | |
| SCHEMBL7319347 | 0.84 | CYP2C19 (0.57) | EPHX1GABBR2GABBR1TAAR1HTR2A | |
| SCHEMBL197934 | 0.84 | CYP2C19 (0.57) | EPHX1GABBR2GABBR1TAAR1HTR2A | |
| SCHEMBL7319341 | 0.84 | CYP2C19 (0.57) | EPHX1GABBR2GABBR1TAAR1HTR2A | |
| SCHEMBL27582649 | 0.84 | GABBR2 (0.53) | EPHX1GABBR2GABBR1TAAR1HTR2A | |
| SCHEMBL27691659 | 0.83 | EPHX1 (0.61) | EPHX1GABBR2GABBR1TAAR1HTR2A | |
| SCHEMBL16881947 | 0.83 | EPHX1 (0.66) | EPHX1GABBR2GABBR1CYP2C19CYP2D6 | |
| SCHEMBL6359024 | 0.83 | EPHX1 (0.66) | EPHX1GABBR2GABBR1CYP2C19CYP2D6 | |
| Hydrochloric Acid SCHEMBL7609245 | 0.83 | CYP2C19 (0.55) | EPHX1GABBR2GABBR1TAAR1HTR2A |
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 45 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103787895-A | Production process for synthesizing 4-bromo-2-methylaniline | ANHUI HUARUN PAINTS CO LTD | 2014-05-14 | — | — | CN | claimed |
| CN-103384662-A | Novel 1, 2-bis-sulfonamide derivatives as chemokine receptor modulators | ALLERGAN INC | 2013-11-06 | — | — | CN | claimed |
| CN-101790374-A | Use of kncq potassium channel openers for reducing symptoms of or treating disorders or conditions wherein the dopaminergic system is disrupted | LUNDBECK & CO AS H | 2010-07-28 | — | — | CN | claimed |
| CN-101228120-A | HIV reverse transcriptase inhibitors | MERCK & CO INC (US) | 2008-07-23 | — | — | CN | claimed |
| CN-1761464-A | Substituted p-diaminobenzene derivatives | LUNDBECK & CO AS H (DK) | 2006-04-19 | — | — | CN | claimed |
| CN-1213038-C | Benzophenones as reverse transcriptase inhibitors | GLAXO GROUP LTD (GB) | 2005-08-03 | — | — | CN | claimed |
| CN-1073097-C | Aniline derivatives having herbicidal activity their prepn. and their use | SANKYO CO (JP) | 2001-10-17 | — | — | CN | claimed |
| CN-1176962-A | Aniline derivatives having herbicidal activity their prepn. and their use | SANKYO CO (JP) | 1998-03-25 | — | — | CN | claimed |
| CN-105062917-A | Chloroacetamide herbicide degrading strain, bacterium produced thereby and application thereof | UNIV NANJING AGRICULTURAL | 2015-11-18 | — | — | CN | disclosed |
| CN-103255154-B | Oxygenase gene caceO as well as coded protein and application of oxygenase gene | UNIV NANJING AGRICULTURAL | 2014-07-02 | — | — | CN | disclosed |
| CN-103787895-A | Production process for synthesizing 4-bromo-2-methylaniline | ANHUI HUARUN PAINTS CO LTD | 2014-05-14 | — | — | CN | disclosed |
| CN-103384662-A | Novel 1, 2-bis-sulfonamide derivatives as chemokine receptor modulators | ALLERGAN INC | 2013-11-06 | — | — | CN | disclosed |
| CN-101420955-B | Dihydrodiazepines useful as inhibitors of protein kinases | VERTEX PHARMA | 2013-07-17 | — | — | CN | disclosed |
| CN-101378742-B | Use of KCNQ-openers for the preparation of a pharmaceutical composition for the treatment of schizophrenia | LUNDBECK & CO AS H | 2013-07-10 | — | — | CN | disclosed |
| US-6150335-A | TREATMENT FOR PAIN | ASTRA AB (SE) | 2000-11-21 | — | — | US | disclosed |
| WO-2000043369-A1 | COMPOUNDS WHICH INHIBIT LEUKOCYTE ADHESION MEDIATED BY VLA-4 | ELAN PHARMACEUTICALS, INC. (US) | 2000-07-27 | — | — | WO | disclosed |
| CN-1257474-A | New nitromethylketone compounds, process for their preparation and compositions containing them | MERCK PATENT GMBH (DE) | 2000-06-21 | — | — | CN | disclosed |
| EP-0946588-A1 | USE OF DIPEPTIDE DERIVATIVES | Astra Aktiebolag (publ) (SE) | 1999-10-06 | — | — | EP | disclosed |
| WO-1998028327-A1 | NEW USE OF DIPEPTIDE DERIVATIVES | ASTRA AKTIEBOLAG (PUBL) (SE) | 1998-07-02 | — | — | WO | disclosed |
| CN-1176962-A | Aniline derivatives having herbicidal activity their prepn. and their use | SANKYO CO (JP) | 1998-03-25 | — | — | CN | disclosed |