Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Paraquat. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MARS1 | P56192 | 6/20 | 0.43 |
| ▸ | RPA1 | P27694 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 5/20 | 0.38 |
| ▸ | CNR2 | P34972 | 5/20 | 0.38 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL123976 | 0.88 | HTT (0.53) | HTTLMNAMARS1RPA1CNR1 | |
| SCHEMBL29355367 | 0.88 | HTT (0.53) | HTTLMNAMARS1RPA1CNR1 | |
| Acrylic Acid SCHEMBL23706633 | 0.81 | HTT (0.47) | HTTLMNAMARS1RPA1CNR1 | |
| SCHEMBL12394479 | 0.77 | CNR1 (0.47) | HTTLMNACNR1CNR2GABRA2 | |
| Dcmu SCHEMBL2372890 | 0.75 | APEX1 (0.50) | HTTLMNARPA1CNR1CNR2 | |
| Propanil SCHEMBL2372923 | 0.75 | CYP3A4 (0.50) | HTTLMNACNR1CNR2 | |
| Glyphosate SCHEMBL2373051 | 0.74 | HTT (0.40) | HTTLMNAMARS1RPA1CNR1 | |
| Quinclorac SCHEMBL14655301 | 0.74 | ALK (0.43) | HTTLMNAMARS1RPA1CNR1 | |
| Fenchlorazol-Ethyl SCHEMBL125425 | 0.74 | KMT2A (0.54) | CNR1GABRA2GABRB2 | |
| Fenchlorazol-Ethyl SCHEMBL5096209 | 0.74 | KMT2A (0.54) | CNR1GABRA2GABRB2 |
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 43 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3630734-A1 | BENZAMIDE COMPOUNDS AND THEIR USE AS HERBICIDES | BASF SE (DE) | 2020-04-08 | — | — | EP | disclosed |
| EP-3630735-A1 | BENZAMIDE COMPOUNDS AND THEIR USE AS HERBICIDES II | BASF SE (DE) | 2020-04-08 | — | — | EP | disclosed |
| WO-2019016385-A1 | BENZAMIDE COMPOUNDS AND THEIR USE AS HERBICIDES | BASF SE (DE) | 2019-01-24 | — | — | WO | disclosed |
| WO-2018234371-A1 | BENZAMIDE COMPOUNDS AND THEIR USE AS HERBICIDES | BASF SE (DE) | 2018-12-27 | — | — | WO | disclosed |
| WO-2018219936-A1 | BENZAMIDE COMPOUNDS AND THEIR USE AS HERBICIDES II | BASF SE (DE) | 2018-12-06 | — | — | WO | disclosed |
| WO-2018219935-A1 | BENZAMIDE COMPOUNDS AND THEIR USE AS HERBICIDES | BASF SE (DE) | 2018-12-06 | — | — | WO | disclosed |
| EP-3055297-A1 | SUBSTITUTED N-(TETRAZOL-5-YL)- AND N-(TRIAZOL-5-YL)ARYLCARBOXAMIDE COMPOUNDS AND THEIR USE AS HERBICIDES | BASF SE (DE) | 2016-08-17 | — | — | EP | disclosed |
| EP-3055305-A1 | SUBSTITUTED 1,2,5-OXADIAZOLE COMPOUNDS AND THEIR USE AS HERBICIDES | BASF SE (DE) | 2016-08-17 | — | — | EP | disclosed |
| EP-3022190-A1 | SUBSTITUTED N-(1,2,4-TRIAZOL-3-YL)ARYLCARBOXAMIDE COMPOUNDS AND THEIR USE AS HERBICIDES | BASF SE (DE) | 2016-05-25 | — | — | EP | disclosed |
| EP-2997016-A1 | SUBSTITUTED N-(TETRAZOL-5-YL)- AND N-(TRIAZOL-5-YL)ARYLCARBOXAMIDE COMPOUNDS AND THEIR USE AS HERBICIDES | BASF SE (DE) | 2016-03-23 | — | — | EP | disclosed |
| WO-2013072450-A1 | SUBSTITUTED 1,2,5-OXADIAZOLE COMPOUNDS AND THEIR USE AS HERBICIDES III | BASF SE (DE) | 2013-05-23 | — | — | WO | disclosed |
| WO-2013072402-A1 | SUBSTITUTED 1,2,5-OXADIAZOLE COMPOUNDS AND THEIR USE AS HERBICIDES II | BASF SE (DE) | 2013-05-23 | — | — | WO | disclosed |
| WO-2013072528-A2 | SUBSTITUTED N-(TETRAZOL-5-YL)- AND N-(TRIAZOL-5-YL)PYRIDIN-3-YL-CARBOXAMIDE COMPOUNDS AND THEIR USE AS HERBICIDES | BASF SE (DE) | 2013-05-23 | — | — | WO | disclosed |
| WO-2013072300-A1 | SUBSTITUTED 1,2,5-OXADIAZOLE COMPOUNDS AND THEIR USE AS HERBICIDES | BASF SE (DE) | 2013-05-23 | — | — | WO | disclosed |
| EP-2550280-A1 | PYRIDOTHIAZINES HAVING HERBICIDAL ACTION | BASF SE (DE) | 2013-01-30 | — | — | EP | disclosed |
| EP-2550270-A1 | SUBSTITUTED PYRIDAZINES HAVING HERBICIDAL ACTION | BASF SE (DE) | 2013-01-30 | — | — | EP | disclosed |
| EP-2550276-A1 | SUBSTITUTED PYRIDINES HAVING HERBICIDAL ACTION | BASF SE (DE) | 2013-01-30 | — | — | EP | disclosed |
| EP-2550271-A1 | SUBSTITUTED PYRIDINES HAVING HERBICIDAL ACTION | BASF SE (DE) | 2013-01-30 | — | — | EP | disclosed |
| EP-2550277-A1 | SUBSTITUTED PYRIDAZINES HAVING HERBICIDAL ACTION | BASF SE (DE) | 2013-01-30 | — | — | EP | disclosed |
| EP-2550279-A1 | PYRAZINOTHIAZINES HAVING HERBICIDAL ACTION | BASF SE (DE) | 2013-01-30 | — | — | EP | disclosed |