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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 2/20 | 0.87 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.87 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.87 |
| ▸ | HPGD | P15428 | 1/20 | 0.87 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.87 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.87 |
| ▸ | RECQL | P46063 | 1/20 | 0.87 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.87 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.87 |
| ▸ | CA1 | P00915 | 18/20 | 0.57 |
| ▸ | CA2 | P00918 | 18/20 | 0.57 |
| ▸ | CA12 | O43570 | 13/20 | 0.57 |
| ▸ | CA9 | Q16790 | 13/20 | 0.57 |
| ▸ | CA4 | P22748 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11695725 | 0.93 | THRB (0.87) | THRBALDH1A1CYP3A4HPGDALOX15 | |
| SCHEMBL11697836 | 0.93 | THRB (0.87) | THRBALDH1A1CYP3A4HPGDALOX15 | |
| SCHEMBL11696734 | 0.93 | THRB (0.87) | THRBALDH1A1CYP3A4HPGDALOX15 | |
| Zinc Ion SCHEMBL8406612 | 0.93 | THRB (1.00) | THRBALDH1A1CYP3A4HPGDALOX15 | |
| SCHEMBL20721 | 0.93 | THRB (0.87) | THRBALDH1A1CYP3A4HPGDALOX15 | |
| SCHEMBL5308757 | 0.93 | THRB (1.00) | THRBALDH1A1CYP3A4HPGDALOX15 | |
| Zinc Ion SCHEMBL21691 | 0.93 | THRB (1.00) | THRBALDH1A1CYP3A4HPGDALOX15 | |
| SCHEMBL11691156 | 0.93 | THRB (0.87) | THRBALDH1A1CYP3A4HPGDALOX15 | |
| SCHEMBL3674278 | 0.93 | THRB (0.87) | THRBALDH1A1CYP3A4HPGDALOX15 | |
| SCHEMBL11861989 | 0.93 | THRB (0.87) | THRBALDH1A1CYP3A4HPGDALOX15 |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-11049746-A | — | — | None | — | — | JP | disclosed |
| JP-10310571-A | — | — | None | — | — | JP | disclosed |
| JP-10310570-A | — | — | None | — | — | JP | disclosed |
| EP-2207416-B1 | ENHANCED RETENTION CAPABILITIES THROUGH METHODS COMPRISING SURFACE TREATMENT OF FUNCTIONAL PARTICULATE CARRIER MATERIALS, AND FUNCTIONAL PARTICULATE CARRIER MATERIALS MADE THEREFROM | IMERYS FILTRATION MINERALS INC (US) | 2018-11-07 | — | — | EP | disclosed |
| US-20100239679-A1 | ENHANCED RETENTION CAPABILITIES THROUGH METHODS COMPRISING SURFACE TREATMENT OF FUNCTIONAL PARTICULATE CARRIER MATERIALS, AND FUNCTIONAL PARTICULATE CARRIER MATERIALS MADE THEREFROM | WORLD MINERALS, INC. (US) | 2010-09-23 | — | — | US | disclosed |
| EP-2207416-A1 | ENHANCED RETENTION CAPABILITIES THROUGH METHODS COMPRISING SURFACE TREATMENT OF FUNCTIONAL PARTICULATE CARRIER MATERIALS, AND FUNCTIONAL PARTICULATE CARRIER MATERIALS MADE THEREFROM | World Minerals, Inc. (US) | 2010-07-21 | — | — | EP | disclosed |
| WO-2009045941-A1 | ENHANCED RETENTION CAPABILITIES THROUGH METHODS COMPRISING SURFACE TREATMENT OF FUNCTIONAL PARTICULATE CARRIER MATERIALS, AND FUNCTIONAL PARTICULATE CARRIER MATERIALS MADE THEREFROM | WORLD MINERALS, INC. (US) | 2009-04-09 | — | — | WO | disclosed |
| JP-H1149746-A | CONCENTRATED AQUEOUS SOLUTION CONTAINING ETHYLENEBISDITHIOCARBAMATE HAVING LOW-TEMPERATURE CRYSTALLIZATION STABILITY | OOUCHI SHINKO KAGAKU KOGYO KK | 1999-02-23 | — | — | JP | disclosed |
| JP-H10310570-A | AQUEOUS SOLUTION OF CALCIUM ETHYLENEBIS(THIOCARBAMATE) HAVING LOW-TEMPERATURE CRYSTALLIZATION STABILITY | OOUCHI SHINKO KAGAKU KOGYO KK | 1998-11-24 | — | — | JP | disclosed |
| JP-H10310571-A | AQUEOUS SOLUTION CONTAINING CALCIUM AND SODIUM ETHYLENEBIS(THIOCARBAMATE) HAVING LOW-TEMPERATURE CRYSTALLIZATION STABILITY | OOUCHI SHINKO KAGAKU KOGYO KK | 1998-11-24 | — | — | JP | disclosed |
| US-4482759-A | Fungicidally active benzhydrol derivatives | DEGUSSA AKTIENGESELLSCHAFT (DE) | 1984-11-13 | — | — | US | disclosed |
| US-4324799-A | Fungicidal thioglycolic acid anilides, processes for their manufacture and pesticidal compositions containing them | HOECHST AKTIENGESELLSCHAFT (DE) | 1982-04-13 | — | — | US | disclosed |
| US-4020252-A | FERRIC ETHYLENE-BISDITHIOCARBAMATE | THE YOKOHAMA RUBBER CO., LTD. (JA) | 1977-04-26 | — | — | US | disclosed |
| US-3932509-A | FUNGICIDES, VIRICIDES | CIBA-GEIGY CORPORATION (US) | 1976-01-13 | — | — | US | disclosed |