Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3830263

Cl.N[C@H]1C[C@H](c2ccccc2)OC1=O

nearest known ligand 0.44

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 Hydrochloric 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
MAOB known ✓ P27338 13/20 0.44
MAOA known ✓ P21397 8/20 0.44
CYP19A1 known ✓ P11511 3/20 0.42
HTR1A known ✓ P08908 1/20 0.41
ADRA2A known ✓ P08913 1/20 0.41
SLC6A2 known ✓ P23975 1/20 0.41
HTR2C known ✓ P28335 1/20 0.41
ADRA1A known ✓ P35348 1/20 0.41
DRD3 known ✓ P35462 1/20 0.41
SLC6A3 known ✓ Q01959 1/20 0.41
KCNH2 known ✓ Q12809 1/20 0.41
KDM1A O60341 5/20 0.44
TAAR1 Q96RJ0 2/20 0.44
LMNA P02545 2/20 0.44
KDM1B Q8NB78 1/20 0.44
BLM P54132 1/20 0.44
PMP22 Q01453 1/20 0.44
HSD17B10 Q99714 2/20 0.42
KDM4E B2RXH2 2/20 0.42
AR P10275 2/20 0.42

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
Hydrochloric Acid SCHEMBL3824895 1.00 MAOB (0.44) MAOBMAOAKDM1ATAAR1LMNA
Hydrochloric Acid SCHEMBL3814923 1.00 MAOB (0.44) MAOBMAOAKDM1ATAAR1LMNA
SCHEMBL28982646 0.98 TSHR (0.43) MAOBMAOAKDM1ATAAR1LMNA
SCHEMBL30286124 0.98 TSHR (0.43) MAOBMAOAKDM1ATAAR1LMNA
SCHEMBL13039624 0.79 TSHR (0.46) MAOBMAOAKDM1ATAAR1LMNA
SCHEMBL12679302 0.77 TSHR (0.45) MAOBCYP19A1HSD17B10KDM4EAR
SCHEMBL18099888 0.76 TSHR (0.43) MAOBMAOACYP19A1HSD17B10KDM4E
SCHEMBL3816926 0.76 MAOB (0.47) MAOBMAOACYP19A1HSD17B10KDM4E
SCHEMBL6288848 0.76 TSHR (0.43) MAOBMAOACYP19A1HSD17B10KDM4E
SCHEMBL5936332 0.76 TSHR (0.43) MAOBMAOACYP19A1HSD17B10KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1507010-B1 Control of the gene expression in eukaryotic cells CALGENE LLC (US) 2009-08-12 EP disclosed
US-7202085-B2 Control of gene expression in eukaryotic cells CALGENE LLC (US) 2007-04-10 US disclosed
EP-1190079-B1 CONTROL OF GENE EXPRESSION IN EUKARYOTIC CELLS CALGENE LLC (US) 2006-08-23 EP disclosed
US-20050227285-A1 Control of gene expression in eukaryotic cells MONSANTO COMPANY 2005-10-13 US disclosed
US-6943243-B2 Control of gene expression in eukaryotic cells CALGENE LLC (US) 2005-09-13 US disclosed
EP-1507010-A2 Control of the gene expression in eukaryotic cells Calgene LLC (US) 2005-02-16 EP disclosed
US-20030224483-A1 Control of gene expression in eukaryotic cells MONSANTO COMPANY 2003-12-04 US disclosed
US-6518066-B1 Control of gene expression in eukaryotic cells CALGENE LLC 2003-02-11 US disclosed
EP-1190079-A2 CONTROL OF GENE EXPRESSION IN EUKARYOTIC CELLS Calgene LLC (US) 2002-03-27 EP disclosed
WO-2001002593-A2 CONTROL OF GENE EXPRESSION IN EUKARYOTIC CELLS CALGENE LLC (US) 2001-01-11 WO disclosed