Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA4 | P22748 | 1/20 | 0.54 |
| ▸ | TGM2 | P21980 | 2/20 | 0.51 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | LTA4H | P09960 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 2/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
| ▸ | MMP1 | P03956 | 1/20 | 0.44 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | MMP9 | P14780 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| Diphenylether SCHEMBL27669850 | 0.89 | TGM2 (0.57) | TGM2THRBLTA4HNPC1RAB9A | |
| Acrylic Acid Methyl Ester SCHEMBL28276158 | 0.89 | THRB (0.50) | TGM2THRBGAAALDH1A1SMN1; SMN2 | |
| Anisole SCHEMBL7290982 | 0.86 | CA4 (0.61) | CA4TGM2THRBCES2CES1 | |
| Acrylic Acid Methyl Ester SCHEMBL28231086 | 0.85 | THRB (0.47) | CA4TGM2THRBNPC1RAB9A | |
| Anisole SCHEMBL28780062 | 0.84 | CA4 (0.58) | CA4TGM2THRBCES2CES1 | |
| Biphenyl SCHEMBL5899505 | 0.84 | MAPT (0.45) | TGM2THRBALDH1A1SMN1; SMN2TSHR | |
| Acrylic Acid Methyl Ester SCHEMBL7194299 | 0.83 | HCAR2 (0.48) | TGM2THRBALDH1A1TSHRCA1 | |
| Phenol SCHEMBL11827525 | 0.82 | CA12 (0.47) | CA4TGM2THRBCES2ALDH1A1 | |
| Anthracene SCHEMBL5356613 | 0.82 | KDM4E (0.47) | TGM2THRBNPC1RAB9AALDH1A1 | |
| Phenol SCHEMBL27502578 | 0.82 | CA12 (0.47) | CA4TGM2THRBCES2ALDH1A1 |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103483260-B | 1-aryl-5-alkylpyrazole derivative compounds, methods of making and methods of use thereof | 梅瑞尔公司 | 2016-08-03 | — | — | CN | disclosed |
| CN-103483263-B | Arylpyrrol-2-yl cyanoethylamino compounds, process for their preparation and their use | MERIAL LTD. (US) | 2016-04-13 | — | — | CN | disclosed |
| CN-102239151-B | Thioamide compounds, methods of making and methods of using the same | MERIAL LTD | 2014-07-02 | — | — | CN | disclosed |
| CN-103483263-A | Arylpyrrol-2-yl cyanoethylamino compounds, process for their preparation and their use | MERIAL LTD | 2014-01-01 | — | — | CN | disclosed |
| CN-103483260-A | 1-aryl-5-alkylpyrazole derivative compounds, methods of making and methods of use thereof | AVENTIS AGRICULTURE | 2014-01-01 | — | — | CN | disclosed |
| CN-101511795-B | 1-aryl-5-alkylpyrazole derivative compounds, methods of making and methods of use thereof | AVENTIS AGRICULTURE | 2013-09-18 | — | — | CN | disclosed |
| CN-101743230-B | Arylpyrrol-2-yl cyanoethylamino compounds, process for their preparation and their use | MERIAL LTD | 2013-06-05 | — | — | CN | disclosed |
| CN-102239151-A | Thioamide compounds, methods of making and methods of using the same | MERIAL LTD | 2011-11-09 | — | — | CN | disclosed |
| CN-101743230-A | Arylpyrrol-2-yl cyanoethylamino compounds, process for their preparation and their use | AVENTIS AGRICULTURE | 2010-06-16 | — | — | CN | disclosed |
| CN-101511795-A | 1-aryl-5-alkylpyrazole derivative compounds, methods of making and methods of use thereof | AVENTIS AGRICULTURE (FR) | 2009-08-19 | — | — | CN | disclosed |
| US-7157530-B2 | Catalyst system for controlled polymerization | CARNEGIE MELLON UNIVERSITY (US) | 2007-01-02 | — | — | US | disclosed |
| US-6790919-B2 | USING A HYBRID CATALYST SYSTEM COMPRISING TRANSITION METAL COMPLEXES HELD IN CLOSE CONJUNCTION WITH A LIGAND-ATTACHED SOLID SUPPORT AND A SOLUBLE LIGAND; ADDITION POLYMERIZATION | CARNEGIE MELLON UNIVERSITY | 2004-09-14 | — | — | US | disclosed |
| US-20020128405-A1 | Catalyst system for controlled polymerization | CARNEGIE MELLON UNIVERSITY | 2002-09-12 | — | — | US | disclosed |
| WO-2002028914-A2 | A CATALYST SYSTEM FOR CONTROLLED POLYMERIZATION | CARNEGIE MELLON UNIVERSITY (US) | 2002-04-11 | — | — | WO | disclosed |
| CN-1090848-A | Oxadiazole and thiadiazoles derivative | ZENECA LTD (GB) | 1994-08-17 | — | — | CN | disclosed |