Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.45 |
| ▸ | CES1 | P23141 | 1/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.45 |
| ▸ | NQO2 | P16083 | 1/20 | 0.45 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.44 |
| ▸ | CYP1A1 | P04798 | 4/20 | 0.44 |
| ▸ | CYP1B1 | Q16678 | 4/20 | 0.44 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL7071411 | 1.00 | CYP1A2 (0.52) | CYP1A2AKR1C3HDAC3ADAM17HDAC1 | |
| SCHEMBL8392279 | 1.00 | CYP1A2 (0.52) | CYP1A2AKR1C3HDAC3ADAM17HDAC1 | |
| SCHEMBL2957449 | 0.83 | CYP1A2 (0.50) | CYP1A2AKR1C3HDAC1SRD5A2 | |
| SCHEMBL2957447 | 0.83 | CYP1A2 (0.50) | CYP1A2AKR1C3HDAC1SRD5A2 | |
| SCHEMBL14280866 | 0.82 | CYP1A2 (0.53) | CYP1A2AKR1C3HDAC3ADAM17HDAC1 | |
| SCHEMBL30587844 | 0.82 | CYP1A2 (0.53) | CYP1A2AKR1C3HDAC3ADAM17HDAC1 | |
| SCHEMBL5382427 | 0.82 | TP53 (0.55) | CYP1A2AKR1C3HDAC3ADAM17HDAC1 | |
| SCHEMBL6933104 | 0.79 | AKR1C3 (0.60) | CYP1A2AKR1C3HDAC3ADAM17HDAC1 | |
| SCHEMBL6933101 | 0.79 | AKR1C3 (0.60) | CYP1A2AKR1C3HDAC3ADAM17HDAC1 | |
| SCHEMBL700921 | 0.79 | MAOB (0.50) | CES2SRD5A2MAOBP4HB |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0946492-B1 | NOVEL 2-FLUOROACRYLIC ACID DERIVATIVES, NOVEL MIXTURES OF HERBICIDES AND ANTIDOTES AND THE USE THEREOF | BAYER CROPSCIENCE GMBH (DE) | 2003-06-18 | — | — | EP | claimed |
| CN-111592519-B | Fluorine-containing carboxylic acid compound and preparation method thereof | 四川大学 | 2021-03-23 | — | — | CN | disclosed |
| CN-111592519-A | Fluorine-containing carboxylic acid compound and preparation method thereof | 四川大学 | 2020-08-28 | — | — | CN | disclosed |
| EP-0946492-B1 | NOVEL 2-FLUOROACRYLIC ACID DERIVATIVES, NOVEL MIXTURES OF HERBICIDES AND ANTIDOTES AND THE USE THEREOF | BAYER CROPSCIENCE GMBH (DE) | 2003-06-18 | — | — | EP | disclosed |
| US-5972839-A | MIXTURE WITH PLANT SAFENING AGENT | HOECHST SCHERING AGREVO GMBH (DE) | 1999-10-26 | — | — | US | disclosed |
| EP-0946492-A1 | NOVEL 2-FLUOROACRYLIC ACID DERIVATIVES, NOVEL MIXTURES OF HERBICIDES AND ANTIDOTES AND THE USE THEREOF | Hoechst Schering AgrEvo GmbH (DE) | 1999-10-06 | — | — | EP | disclosed |
| WO-1998027049-A1 | NOVEL 2-FLUOROACRYLIC ACID DERIVATIVES, NOVEL MIXTURES OF HERBICIDES AND ANTIDOTES AND THE USE THEREOF | HOECHST SCHERING AGREVO GMBH (DE) | 1998-06-25 | — | — | WO | disclosed |