SCHEMBL30209463

SCHEMBL30209463

C=C(C(=O)[O-])C(=O)[O-].[Na+].[Na+]

nearest known ligand 0.54

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 9)

geneUniProtsupporting neighboursconfidence
CA4 known ✓ P22748 4/20 0.54
CA1 known ✓ P00915 2/20 0.40
FAHD1 Q6P587 1/20 0.54
MEN1 O00255 1/20 0.44
LDHA P00338 1/20 0.44
BLM P54132 1/20 0.44
KMT2A Q03164 1/20 0.44
LMNA P02545 1/20 0.33
CASP1 P29466 1/20 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.

Compoundsimilaritytop predictedshared targets
Potassium Ion SCHEMBL31299675 0.96 CA4 (0.46) CA4FAHD1MEN1LDHABLM
Lithium Ion SCHEMBL31310423 0.92 CA4 (0.43) CA4FAHD1MEN1LDHABLM
SCHEMBL18740437 0.92
SCHEMBL28083331 0.79
Potassium Ion SCHEMBL28006508 0.77
SCHEMBL2359525 0.75
Methacrylic Acid SCHEMBL4818992 0.72 CA4 (0.60) CA4FAHD1MEN1LDHABLM
Methacrylic Acid SCHEMBL31501592 0.72 CA4 (0.60) CA4FAHD1MEN1LDHABLM
SCHEMBL5075248 0.72
Methacrylic Acid SCHEMBL8503458 0.72 CA4 (0.60) CA4FAHD1MEN1LDHABLM

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118930706-A Fluoropolymer, conductive paste, negative electrode sheet, secondary battery, and electricity device 宁德时代新能源科技股份有限公司 2024-11-12 CN claimed
CN-115353578-A Poly (2-carboxy acrylic acid) and application thereof in nano-drugs 大连合元医疗器械有限公司 2022-11-18 CN disclosed