Gallic Acid

Gallic Acid

SCHEMBL5146651

O.O=C(O)c1cc(O)c(O)c(O)c1.O=C(O)c1cc(O)c(O)c(O)c1.O=C(O)c1cc(O)c(O)c(O)c1.[GaH3]

nearest known ligand 0.90

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO

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

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 known ✓ P27487 1/20 0.90
PTGS2 known ✓ P35354 2/20 0.59
EGFR known ✓ P00533 1/20 0.46
TOP1 known ✓ P11387 1/20 0.45
CA12 O43570 4/20 0.90
CA1 P00915 4/20 0.90
CA2 P00918 4/20 0.90
CA7 P43166 4/20 0.90
CA9 Q16790 4/20 0.90
CA14 Q9ULX7 4/20 0.90
KDM4E B2RXH2 4/20 0.90
MAPT P10636 3/20 0.90
CA4 P22748 3/20 0.90
CA6 P23280 3/20 0.90
LMNA P02545 3/20 0.90
TDP1 Q9NUW8 3/20 0.90
ALDH1A1 P00352 2/20 0.90
FUT7 Q11130 2/20 0.90
CA3 P07451 2/20 0.90
CA5A P35218 2/20 0.90

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
Gallic Acid SCHEMBL1334688 0.97 CA12 (0.94) CA12CA1CA2CA7CA9
Gallic Acid SCHEMBL27904848 0.97 CA12 (0.94) CA12CA1CA2CA7CA9
Gallic Acid SCHEMBL29158008 0.97 CA12 (0.94) CA12CA1CA2CA7CA9
Gallic Acid SCHEMBL3137007 0.95 CA12 (0.90) CA12CA1CA2CA7CA9
Gallic Acid SCHEMBL28311723 0.95 CA12 (0.90) CA12CA1CA2CA7CA9
Gallic Acid SCHEMBL28613864 0.95 CA12 (0.90) CA12CA1CA2CA7CA9
Gallic Acid SCHEMBL15012 0.95 CA12 (1.00) CA12CA1CA2CA7CA9
Gallic Acid SCHEMBL4918056 0.95 CA12 (1.00) CA12CA1CA2CA7CA9
Gallic Acid SCHEMBL678990 0.95 CA12 (1.00) CA12CA1CA2CA7CA9
Gallic Acid SCHEMBL1845406 0.95 CA12 (1.00) CA12CA1CA2CA7CA9

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
US-7202182-B2 Method of passivating oxide/compound semiconductor interface FREESCALE SEMICONDUCTOR, INC. (US) 2007-04-10 US claimed
US-20060003595-A1 Method of passivating oxide/compound semiconductor interface NXP, B.V. F/K/A FREESCALE SEMICONDUCTOR, INC. (NL) 2006-01-05 US claimed
US-7202182-B2 Method of passivating oxide/compound semiconductor interface FREESCALE SEMICONDUCTOR, INC. (US) 2007-04-10 US disclosed
US-20060003595-A1 Method of passivating oxide/compound semiconductor interface NXP, B.V. F/K/A FREESCALE SEMICONDUCTOR, INC. (NL) 2006-01-05 US disclosed