Known targets — ChEMBL curated mechanism
ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
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 known ✓ | P10828 | 2/20 | 0.93 |
| ▸ | CA1 known ✓ | P00915 | 18/20 | 0.62 |
| ▸ | CA2 known ✓ | P00918 | 18/20 | 0.62 |
| ▸ | CA12 known ✓ | O43570 | 13/20 | 0.56 |
| ▸ | CA4 known ✓ | P22748 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.81 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.81 |
| ▸ | HPGD | P15428 | 1/20 | 0.81 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.81 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.81 |
| ▸ | RECQL | P46063 | 1/20 | 0.81 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.81 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.81 |
| ▸ | CA9 | Q16790 | 13/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL3674278 | 0.97 | THRB (0.87) | THRBALDH1A1CYP3A4HPGDALOX15 | |
| SCHEMBL20721 | 0.97 | THRB (0.87) | THRBALDH1A1CYP3A4HPGDALOX15 | |
| SCHEMBL5308757 | 0.97 | THRB (1.00) | THRBALDH1A1CYP3A4HPGDALOX15 | |
| SCHEMBL137550 | 0.97 | THRB (1.00) | THRBALDH1A1CYP3A4HPGDALOX15 | |
| SCHEMBL121138 | 0.93 | THRB (0.81) | THRBALDH1A1CYP3A4HPGDALOX15 | |
| Water SCHEMBL9862691 | 0.93 | THRB (0.81) | THRBALDH1A1CYP3A4HPGDALOX15 | |
| Zinc Ion SCHEMBL4181998 | 0.93 | THRB (0.93) | THRBALDH1A1CYP3A4HPGDALOX15 | |
| Zinc Ion SCHEMBL22430 | 0.93 | THRB (0.93) | THRBALDH1A1CYP3A4HPGDALOX15 | |
| SCHEMBL4992032 | 0.93 | THRB (0.81) | THRBALDH1A1CYP3A4HPGDALOX15 | |
| Water SCHEMBL28117119 | 0.93 | THRB (0.93) | 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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2710160-A2 | RECOVERY REACTOR | UPL Limited (IN) | 2014-03-26 | — | — | EP | disclosed |
| WO-2012160494-A2 | RECOVERY REACTOR | UNITED PHOSPHORUS LIMITED (IN) | 2012-11-29 | — | — | WO | disclosed |
| EP-0639207-A4 | PROCESS FOR PRODUCING A STABLE BIOCIDE DISPERSION. | OLIN CORP (US) | 1996-03-20 | — | — | EP | disclosed |
| EP-0639207-A1 | PROCESS FOR PRODUCING A STABLE BIOCIDE DISPERSION | OLIN CORPORATION (US) | 1995-02-22 | — | — | EP | disclosed |
| WO-1993023468-A1 | PROCESS FOR PRODUCING A STABLE BIOCIDE DISPERSION | OLIN CORPORATION (US) | 1993-11-25 | — | — | WO | disclosed |