Known targets — ChEMBL curated mechanism
GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHMGCRMMP1MMP13MMP7MMP8PTGS1PTGS2ileSpolrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GMNN | O75496 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | THPO | P40225 | 1/20 | 0.55 |
| ▸ | HBB | P68871 | 1/20 | 0.55 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | BBOX1 | O75936 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | ENPEP | Q07075 | 2/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 2/20 | 0.33 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.32 |
| ▸ | EIF4H | Q15056 | 1/20 | 0.32 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL921255 | 0.93 | TSHR (0.63) | GMNNALDH1A1LMNATP53TSHR | |
| SCHEMBL2289785 | 0.93 | TSHR (0.63) | GMNNALDH1A1LMNATP53TSHR | |
| Lithium Ion SCHEMBL28483872 | 0.93 | GMNN (0.55) | GMNNALDH1A1LMNATP53TSHR | |
| SCHEMBL2292185 | 0.93 | GMNN (0.55) | GMNNALDH1A1LMNATP53TSHR | |
| SCHEMBL3385778 | 0.93 | TSHR (0.63) | GMNNALDH1A1LMNATP53TSHR | |
| SCHEMBL2291877 | 0.93 | GMNN (0.55) | GMNNALDH1A1LMNATP53TSHR | |
| SCHEMBL3386062 | 0.93 | TSHR (0.63) | GMNNALDH1A1LMNATP53TSHR | |
| Potassium Ion SCHEMBL10537906 | 0.93 | GMNN (0.55) | GMNNALDH1A1LMNATP53TSHR | |
| SCHEMBL2288142 | 0.89 | ALDH1A1 (0.58) | GMNNALDH1A1LMNATP53TSHR | |
| SCHEMBL917845 | 0.89 | ALDH1A1 (0.67) | GMNNALDH1A1LMNATP53TSHR |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4443247-A | HERBICIDES, PLANT GROWTH REGULATORS | CIBA-GEIGY CORPORATION (US) | 1984-04-17 | — | — | US | disclosed |
| US-4433998-A | Pyridyloxy-phenoxyalkanecarboxylic acid derivatives and their herbicidal use | CIBA-GEIGY CORPORATION (US) | 1984-02-28 | — | — | US | disclosed |
| US-4425157-A | Pyridyloxy-phenoxy-alkanethiocarboxylic acid ester derivatives and their herbicidal use | CIBA-GEIGY CORPORATION (US) | 1984-01-10 | — | — | US | disclosed |
| US-4412855-A | 2-Chloro-N-(2'-methoxypropyl)- and 2-chloro-N-(2'-ethoxypropyl)-2\",6\"-dimethyl-acetanilide as long term weed killers | CIBA-GEIGY CORPORATION (US) | 1983-11-01 | — | — | US | disclosed |
| US-4384882-A | HERBICIDES, PLANT GROWTH REGULATORS | CIBA-GEIGY CORPORATION (US) | 1983-05-24 | — | — | US | disclosed |
| US-4329167-A | HERBICIDES, PLANT GROWTH REGULATORS | CIBA-GEIGY CORPORATION (US) | 1982-05-11 | — | — | US | disclosed |
| US-4324580-A | A CHLOROACETANILIDE ETHER | CIBA-GEIGY CORPORATION (US) | 1982-04-13 | — | — | US | disclosed |
| US-4225336-A | Phenoxyalkyloxazolines, as selective herbicides in cereals | CIBA-GEIGY CORPORATION (US) | 1980-09-30 | — | — | US | disclosed |
| US-4221581-A | HERBICIDES, PLANT GROWTH REGULATORS | CIBA-GEIGY CORPORATION (US) | 1980-09-09 | — | — | US | disclosed |
| US-4200451-A | 2-ETHYL-6-METHYL-N-(1'-ETHOXYPROP-2'-YL)-N-CHLOROACETANILIDE | CIBA-GEIGY CORPORATION (US) | 1980-04-29 | — | — | US | disclosed |
| US-4168965-A | 2,6-Diethyl-n-(2'-N-propoxyethyl)-chloroacetanilide for selectively combating weeds | CIBA-GEIGY CORPORATION (US) | 1979-09-25 | — | — | US | disclosed |
| US-4129573-A | MAINTAINING TURF IN PBULIC AND TRAFFIC AREAS | CIBA-GEIGY CORPORATION (US) | 1978-12-12 | — | — | US | disclosed |
| US-4116675-A | DEFOLIATION AND DESICCATION OF CROP PLANTS TO FACILITATE HARVESTING | CIBA-GEIGY CORPORATION (US) | 1978-09-26 | — | — | US | disclosed |
| US-4070179-A | Plant growth regulation with N-(2-alkoxy-ethyl)-N-chloroacetyl-2,3,6-trimethyl-anilines | CIBA-GEIGY CORPORATION (US) | 1978-01-24 | — | — | US | disclosed |
| US-4022611-A | 2-ETHYL-6-METHYL-N-(1'-METHOXY-PROP-2'-YL)-N-CHLORO-ACETANILIDE | CIBA-GEIGY CORPORATION (US) | 1977-05-10 | — | — | US | disclosed |
| US-4014677-A | HERBICIDES | CIBA-GEIGY CORPORATION (US) | 1977-03-29 | — | — | US | disclosed |
| US-3937730-A | N-ALKOXY-N-CHLOROACETANILIDE | CIBA-GEIGY CORPORATION (US) | 1976-02-10 | — | — | US | disclosed |