Diatrizoic Acid

Diatrizoic Acid

SCHEMBL6286191

CC(=O)Nc1c(I)c(NC(C)=O)c(I)c(C(=O)[O-])c1I.CC(=O)Nc1c(I)c(NC(C)=O)c(I)c(C(=O)[O-])c1I.[Na+].[Na+]

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Diatrizoic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA1 known ✓ P00915 2/20 0.31
CA2 known ✓ P00918 1/20 0.30
LMNA P02545 4/20 1.00
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CA9 Q16790 1/20 0.30

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
Diatrizoic Acid SCHEMBL37116 1.00 LMNA (1.00) LMNASMN1; SMN2MEN1KMT2ACA1
Diatrizoic Acid SCHEMBL3076099 0.98 LMNA (0.96) LMNASMN1; SMN2MEN1KMT2A
Diatrizoic Acid SCHEMBL19379574 0.98 LMNA (0.96) LMNASMN1; SMN2MEN1KMT2A
Diatrizoic Acid SCHEMBL3338333 0.98 LMNA (0.96) LMNASMN1; SMN2MEN1KMT2A
SCHEMBL8815549 0.96 LMNA (0.92) LMNASMN1; SMN2MEN1KMT2ACA1
Diatrizoic Acid SCHEMBL7198501 0.96 LMNA (0.92) LMNASMN1; SMN2MEN1KMT2ACA1
Diatrizoic Acid SCHEMBL21243193 0.93 LMNA (0.86) LMNASMN1; SMN2MEN1KMT2A
Iothalamic Acid SCHEMBL159919 0.86 LMNA (0.75) LMNASMN1; SMN2
Iothalamic Acid SCHEMBL30496108 0.86 LMNA (0.75) LMNASMN1; SMN2
Metrizoic Acid SCHEMBL11334827 0.84 LMNA (0.71) LMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8552149-B2 Polypeptides and use thereof ALLIGATOR BIOSCIENCE AB (SE) 2013-10-08 US disclosed
US-6884590-B1 Kit for detecting restriction fragnemt length polymorphism in intracellular adhesion molecules and diagnosing inflammatory bowel disease CEDARS-SINAI MEDICAL CENTER (US) 2005-04-26 US disclosed
EP-0846266-B1 DIFFERENTIAL ASSAY FOR ULCERATIVE COLITIS, PRIMARY SCLEROSING CHOLANGITIS AND TYPE 1 AUTOIMMUNE HEPATITIS CEDARS SINAI MEDICAL CENTER (US) 2003-01-29 EP disclosed
EP-0846266-A4 DIFFERENTIAL ASSAY FOR ULCERATIVE COLITIS, PRIMARY SCLEROSING CHOLANGITIS AND TYPE 1 AUTOIMMUNE HEPATITIS CEDARS SINAI MEDICAL CENTER (US) 2001-08-29 EP disclosed
EP-0615129-B1 Methods for selectively detecting perinuclear anti-neutrophil cytoplasmic antibody of ulcerative colitis or primary sclerosing cholangitis CEDARS SINAI MEDICAL CENTER (US) 2000-05-31 EP disclosed
US-6008335-A A KIT FOR DETECTING FOR INFLAMMATORY BOWEL DISEASE HAVING AN OLIGONUCLEOTIDE PROBE WITH AN ARGININE AT POSITION 241, IMMOBILIZED ON A SOLID MATIX, AND AMPLIFYING THE SUBJECT'S NUCLEIC ACID ENCODING AN INTERCELLULAR ADHESION MOLECULE CEDARS-SINAI MEDICAL CENTER (US) 1999-12-28 US disclosed
US-5846777-A Two cDNAs encoding WD-40 proteins INCYTE PHARMACEUTICALS, INC. (US) 1998-12-08 US disclosed
US-5830675-A DIFFERENTIATION OF STAINING PATTERN OF PERINUCLEAR ANTI-NEUTROPHIL CYTOPLASMIC ANTIBODY FOR DIAGNOSIS OF VARIOUS INFLAMMATORY BOWEL DISEASES CEDARS-SINAI MEDICAL CENTER (US) 1998-11-03 US disclosed
EP-0846266-A1 DIFFERENTIAL ASSAY FOR ULCERATIVE COLITIS, PRIMARY SCLEROSING CHOLANGITIS AND TYPE 1 AUTOIMMUNE HEPATITIS Cedars-Sinai Medical Center (US) 1998-06-10 EP disclosed
US-5750355-A TESTING FOR THE PRESENCE OR ABSENCE OF A DETECTABLE COMPLEX OF ALCOHOL-FIXED NEUTROPHILS, P-ANCA AND DETECTABLE SECONDARY ANTIBODY, WHEREIN ONLY THE DNA OF THE NEUTROPHILS HAS BEEN DIGESTED BY DNAASE CEDARS-SINAI MEDICAL CENTER (US) 1998-05-12 US disclosed
EP-0837697-A1 ANTI-NEUTROPHIL CYTOPLASMIC ANTIBODY MATERIAL ASSOCIATED WITH ULCERATIVE COLITIS AND RELATED METHODS AND KITS Cedars-Sinai Medical Center (US) 1998-04-29 EP disclosed
US-5691151-A DETECTION OF ANTIBODY REGENTS OF UNIVERSITY OF CALIFORNIA (US) 1997-11-25 US disclosed
US-5681699-A ASSAYING NUCLEIC ACID SAMPLE FOR THE PRESENCE OF A CODON ENCODING ARGININE AT AMINO ACID POSITION 241 OF INTERCELLULAR ADHESION MOLECULE-1 CEDARS-SINAI MEDICAL CENTER (US) 1997-10-28 US disclosed
WO-1996041183-A1 DIFFERENTIAL ASSAY FOR ULCERATIVE COLITIS, PRIMARY SCLEROSING CHOLANGITIS AND TYPE 1 AUTOIMMUNE HEPATITIS CEDARS-SINAI MEDICAL CENTER (US) 1996-12-19 WO disclosed
WO-1996039186-A1 ANTI-NEUTROPHIL CYTOPLASMIC ANTIBODY MATERIAL ASSOCIATED WITH ULCERATIVE COLITIS AND RELATED METHODS AND KITS CEDARS-SINAI MEDICAL CENTER (US) 1996-12-12 WO disclosed
WO-1996012189-A2 METHODS OF SCREENING FOR ULCERATIVE COLITIS AND CROHN'S DISEASE BY DETECTING VH3-15 AUTOANTIBODY AND pANCA CEDARS-SINAI MEDICAL CENTER (US) 1996-04-25 WO disclosed
WO-1995021941-A1 METHODS OF DIAGNOSING ULCERATIVE COLITIS AND CROHN'S DISEASE CEDARS-SINAI MEDICAL CENTER (US) 1995-08-17 WO disclosed
EP-0615129-A2 Methods for selectively detecting perinuclear anti-neutrophilcytoplasmic antibody of ulcerative colitis or primary sclerosing cholangitis Cedars-Sinai Medical Center (US) 1994-09-14 EP disclosed