SCHEMBL2963002

SCHEMBL2963002

NC(CC(=O)[O-])C(N)C(CC(=O)[O-])(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Na+].[Na+]

nearest known ligand 0.38

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 5)

geneUniProtsupporting neighboursconfidence
CA2 known ✓ P00918 1/20 0.38
CA4 known ✓ P22748 3/20 0.37
CPT2 P23786 1/20 0.35
CPT1A P50416 1/20 0.35
CTSL P07711 1/20 0.31

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
SCHEMBL10703912 0.98 CA4 (0.40) CA2CA4CPT2CPT1ACTSL
SCHEMBL9487128 0.96 CA4 (0.37) CA2CA4CPT2CPT1ACTSL
SCHEMBL8348661 0.93 CA2 (0.33) CA2CA4CPT2CPT1A
SCHEMBL271763 0.70 TDP1 (0.39) CPT2
Potassium Ion SCHEMBL9474315 0.69 CA4 (0.39) CA2CA4CPT2CPT1ACTSL
SCHEMBL2963004 0.69 CA2 (0.56) CA2CA4CPT2CPT1ACTSL
Ammonia Solution, Strong SCHEMBL10701836 0.68 TDP1 (0.42)
SCHEMBL9805121 0.68 TDP1 (0.37)
Aspartic Acid SCHEMBL2117573 0.62 CA4 (0.52) CA2CA4CPT2CPT1ACTSL
Aspartic Acid SCHEMBL21054602 0.62 CA4 (0.52) CA2CA4CPT2CPT1ACTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0283174-A2 Method for processing lightsensitive silver halide color photographic material improved in color restoration KONICA CORPORATION (JP) 1988-09-21 EP claimed
US-7767092-B2 Adding an inorganic metal salt to the colored effluent to form a precipitation; controlling the pH with carboxylic acid; eliminating the precipitation from the colored effluent KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2010-08-03 US disclosed
US-20080110835-A1 DECOLORIZATION METHOD OF COLORED EFFLUENT KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2008-05-15 US disclosed
EP-0283174-A2 Method for processing lightsensitive silver halide color photographic material improved in color restoration KONICA CORPORATION (JP) 1988-09-21 EP disclosed