Pyridoxal

Pyridoxal

SCHEMBL361981

Cc1ncc(CO)c(C=O)c1O.Cl.[I-].[K+]

nearest known ligand 0.94

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1ACEACHEACVR1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALKAVPR1AAVPR2BCHEBCRCA2CACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCASRCCR5CDK4CDK6CFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNA3CHRNA7CHRNB1CHRNB4CHRNDCHRNECHRNGCOXFA4COXFA4L2CRBNCSF1RCUL4ACYP19A1DDB1DPP4DRD1DRD2DRD3DRD4EDNRAEGFREML4ERBB2ERBB4ESR1ESR2FGFR1FGFR3FLT1FLT3FLT4GAAGABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGHSRGLAGNRHRGPD2GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSTP1HCN4HCRTR1HCRTR2HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HRH2HRH3HSD11B1HSP90AA1HSP90AB1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IMPDH1IMPDH2ITGA2BITGB3ITKJAK1JAK2KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNJ2KCNJ3KCNJ5KCNK3KCNK9KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2KDRKITKLKB1LCKMMAOAMAOBMAPK14METMMP1MMP13MMP7MMP8MT-ND1MT-ND2MT-ND3MT-ND4MT-ND4LMT-ND5MT-ND6NDUFA1NDUFA10NDUFA11NDUFA12NDUFA13NDUFA2NDUFA3NDUFA5NDUFA6NDUFA7NDUFA8NDUFA9NDUFAB1NDUFAF1NDUFAF2NDUFAF3NDUFAF4NDUFB1NDUFB10NDUFB11NDUFB2NDUFB3NDUFB4NDUFB5NDUFB6NDUFB7NDUFB8NDUFB9NDUFC1NDUFC2NDUFS1NDUFS2NDUFS3NDUFS4NDUFS5NDUFS6NDUFS7NDUFS8NDUFV1NDUFV2NDUFV3NR3C1NS5ANTRK1NTRK2NTRK3ODC1OPRD1OPRK1OPRM1P2RY12PAHPARP1PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDE5APDE7APDE7BPDE8APDE8BPDGFRAPDGFRBPIK3CAPIK3CDPNPPOLA1POLA2POLD1POLD2POLD3POLD4POLEPOLE2POLE3PPARGPRIM1PRIM2PRKCAPRKCBPRKCDPRKCEPRKCGPRKCHPRKCIPRKCQPRKCZPRKD1PRKD3PTGS1PTGS2RBX1RENRETROCK1ROCK2RPE65RRM1RRM2RRM2BS1PR1S1PR2S1PR3S1PR4S1PR5SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC18A2SLC6A1SLC6A2SLC6A3SLC6A4SLC9A3SRCTACR1TOP1TOP2ATOP2BTTRTYMPdacAdacBdacCembAfolAftsIgyrAgyrBmrcAmrcBmrdAparCparEpolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Pyridoxal. 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
ESR1 known ✓ P03372 1/20 0.57
PTGS1 known ✓ P23219 1/20 0.57
PDE4A known ✓ P27815 1/20 0.57
GAA known ✓ P10253 3/20 0.48
TRIM24 O15164 1/20 0.94
TRIM33 Q9UPN9 1/20 0.94
KDM4E B2RXH2 9/20 0.90
ALDH1A1 P00352 8/20 0.90
LMNA P02545 6/20 0.90
HPGD P15428 5/20 0.90
MEN1 O00255 2/20 0.90
KMT2A Q03164 2/20 0.90
AOX1 Q06278 1/20 0.90
PDXK O00764 2/20 0.64
ACP1 P24666 1/20 0.57
P2RX1 P51575 1/20 0.57
P2RX2 Q9UBL9 1/20 0.57
HSD17B10 Q99714 1/20 0.53
HTT P42858 5/20 0.48
L3MBTL1 Q9Y468 4/20 0.48

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
Pyridoxal SCHEMBL50601 0.97 TRIM24 (1.00) TRIM24TRIM33KDM4EALDH1A1LMNA
Pyridoxal SCHEMBL27840086 0.97 TRIM24 (1.00) TRIM24TRIM33KDM4EALDH1A1LMNA
Pyridoxal SCHEMBL29906 0.95 KDM4E (1.00) TRIM24TRIM33KDM4EALDH1A1LMNA
Pyridoxal SCHEMBL4668019 0.93 KDM4E (0.97) TRIM24TRIM33KDM4EALDH1A1LMNA
Pyridoxal SCHEMBL30963032 0.93 KDM4E (0.97) TRIM24TRIM33KDM4EALDH1A1LMNA
Pyridoxal SCHEMBL5416120 0.93 KDM4E (0.97) TRIM24TRIM33KDM4EALDH1A1LMNA
Pyridoxal SCHEMBL8533734 0.93 KDM4E (0.97) TRIM24TRIM33KDM4EALDH1A1LMNA
Pyridoxal SCHEMBL2527773 0.93 KDM4E (0.97) TRIM24TRIM33KDM4EALDH1A1LMNA
Pyridoxal SCHEMBL29389313 0.93 KDM4E (0.97) TRIM24TRIM33KDM4EALDH1A1LMNA
Pyridoxal SCHEMBL27587627 0.93 KDM4E (0.97) TRIM24TRIM33KDM4EALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9752171-B2 Pentose fermentation by a recombinant microorganism CODEXIS, INC. (US) 2017-09-05 US disclosed
EP-2576804-B1 PENTOSE FERMENTATION BY A RECOMBINANT MICROORGANISM CODEXIS INC (US) 2016-12-14 EP disclosed
US-20160010132-A1 PENTOSE FERMENTATION BY A RECOMBINANT MICROORGANISM INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT 2016-01-14 US disclosed
US-9045745-B2 Pentose fermentation by a recombinant microorganism CODEXIS, INC. (US) 2015-06-02 US disclosed
US-20140242674-A1 PENTOSE FERMENTATION BY A RECOMBINANT MICROORGANISM CODEXIS, INC. (US) 2014-08-28 US disclosed
US-8778652-B2 Pentose fermentation by a recombinant microorganism CODEXIS, INC. (US) 2014-07-15 US disclosed
US-20140017765-A1 PENTOSE FERMENTATION BY A RECOMBINANT MICROORGANISM CODEXIS, INC. (US) 2014-01-16 US disclosed
EP-2576804-A1 PENTOSE FERMENTATION BY A RECOMBINANT MICROORGANISM Codexis, Inc. (US) 2013-04-10 EP disclosed
US-20130071904-A1 ACETATE-RESISTANT YEAST STRAIN FOR THE PRODUCTION OF A FERMENTATION PRODUCT CODEXIS, INC. 2013-03-21 US disclosed
US-20130004998-A1 PENTOSE FERMENTATION BY A RECOMBINANT MICROORGANISM CODEXIS, INC. (US) 2013-01-03 US disclosed
WO-2013003219-A1 PENTOSE FERMENTATION BY A RECOMBINANT MICROORGANISM CODEXIS, INC. (US) 2013-01-03 WO disclosed
WO-2012024046-A2 PENTOSE FERMENTATION BY A RECOMBINANT MICROORGANISM CODEXIS, INC. (US) 2012-02-23 WO disclosed
WO-2012009272-A2 PENTOSE FERMENTATION BY A RECOMBINANT MICROORGANISM CODEXIS, INC. (US) 2012-01-19 WO disclosed
US-20110294170-A1 Pentose Fermentation By a Recombinant Microorganism CODEXIS, INC. (US) 2011-12-01 US disclosed
WO-2011150318-A1 ACETATE-RESISTANT YEAST STRAIN FOR THE PRODUCTION OF A FERMENTATION PRODUCT CODEXIS, INC. (US) 2011-12-01 WO disclosed
WO-2011150313-A1 PENTOSE FERMENTATION BY A RECOMBINANT MICROORGANISM CODEXIS, INC. (US) 2011-12-01 WO disclosed