SCHEMBL926219

SCHEMBL926219

N#CCOP(=O)([O-])[O-].N#CCOP(=O)([O-])[O-].N#CCOP(=O)([O-])[O-].[H+].[H+].[H+].[H+].[Na+].[Na+]

nearest known ligand 0.00

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.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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.

Compoundsimilaritytop predictedshared targets
Potassium Ion SCHEMBL3897706 0.97
Ammonia Solution, Strong SCHEMBL976623 0.97
SCHEMBL937334 0.97
Potassium Ion SCHEMBL3131828 0.95
Potassium Ion SCHEMBL5803916 0.84 SLC34A1 (0.32)
SCHEMBL9098975 0.80
Tetrabuthylammonium SCHEMBL2824667 0.77 SLC22A1 (0.41)
Potassium Ion SCHEMBL5689772 0.75
SCHEMBL6645670 0.75 TSHR (0.38)
SCHEMBL6998232 0.72 ALDH1A1 (0.33)

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105301118-B A kind of detection method of mosapride citrate in relation to substance 成都康弘药业集团股份有限公司 2018-05-25 CN claimed
CN-105301118-A Mosapride citrate related substance detection method CHENGDU KANGHONG PHARMACEUTICAL GROUP CO LTD 2016-02-03 CN claimed
CN-114507127-A Synthesis method of 2-keto pantoic acid 中国科学院上海高等研究院 2022-05-17 CN disclosed
CN-110320289-A Composition containing ACEI, the detection method in relation to substance 南京优科生物医药研究有限公司 2019-10-11 CN disclosed
CN-110320288-A Composition containing ACEI, the method for separating and detecting in relation to substance 南京优科生物医药研究有限公司 2019-10-11 CN disclosed
CN-105301118-B A kind of detection method of mosapride citrate in relation to substance 成都康弘药业集团股份有限公司 2018-05-25 CN disclosed
CN-102365092-B The burdock extract that arctigenin content is high and manufacture method thereof KRACIE PHARMA, LTD. (JP) 2016-05-11 CN disclosed
CN-105521771-A Preparation method and use of boric acid affinity membrane UNIV NORTHWESTERN 2016-04-27 CN disclosed
CN-105301118-A Mosapride citrate related substance detection method CHENGDU KANGHONG PHARMACEUTICAL GROUP CO LTD 2016-02-03 CN disclosed
EP-2620431-A1 Novel crystals of substituted phenylalkanoic acid and production process Asahi Kasei Pharma Corporation (JP) 2013-07-31 EP disclosed
EP-2045244-B1 NOVEL CRYSTAL OF SUBSTITUTED PHENYLALKANOIC ACID AND PRODUCTION PROCESS ASAHI KASEI PHARMA CORP (JP) 2013-04-03 EP disclosed
EP-0863874-B1 PROCESS FOR PREPARING DIOXOAZABICYCLOHEXANES PFIZER LTD (GB) 2000-12-27 EP disclosed
EP-0818446-B1 Process for preparing 2,4-dioxo-3-azabicyclo(3.1.0)hexanes PFIZER LTD (GB) 2000-11-02 EP disclosed
US-5917031-A HEATING MIXTURE OF AT LEAST DEOXYCYTIDINE 5'-TRIPHOSPHATE OR DEOXYGUANOSINE 5'-TRIPHOSPHATE AND HEAT STABLE POLYMERASE FOR TIME FORMING POLYNUCLEOTIDES; SOLUTION HAS NO TEMPLATES OR PRIMERS TAIKO PHARMACEUTICAL CO., LTD. (JP) 1999-06-29 US disclosed
US-5847158-A Process for preparing 2,4-dioxo-3-azabicyclo 3.1.0!Hexanes PFIZER INC. (US) 1998-12-08 US disclosed
EP-0863874-A1 PROCESS FOR PREPARING DIOXOAZABICYCLOHEXANES Pfizer Limited (GB) 1998-09-16 EP disclosed
EP-0818446-A1 Process for preparing 2,4-dioxo-3-azabicyclo(3.1.0)hexanes Pfizer Limited (GB) 1998-01-14 EP disclosed
EP-0802258-A2 Method of synthesizing polydeoxyribonucleotides, method of synthesizing chromosomal DNA and method of producing chromosomes Taiko Pharmaceutical Co., Ltd. (JP) 1997-10-22 EP disclosed
WO-1997019921-A1 PROCESS FOR PREPARING DIOXOAZABICYCLOHEXANES PFIZER LIMITED (GB) 1997-06-05 WO disclosed
US-4704456-A Process for sultamicillin intermediate PFIZER INC. (US) 1987-11-03 US disclosed