Hydrochloric Acid

Hydrochloric Acid

SCHEMBL28511355

Cl.Nc1ccccc1C=CC(=O)O.Nc1ccccc1C=CC(=O)O

nearest known ligand 0.60

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
▸ CA2 known ✓ P00918 1/20 0.60
▸ HDAC3 known ✓ O15379 1/20 0.52
▸ HDAC4 known ✓ P56524 1/20 0.52
▸ HDAC1 known ✓ Q13547 1/20 0.52
▸ HDAC7 known ✓ Q8WUI4 1/20 0.52
▸ HDAC2 known ✓ Q92769 1/20 0.52
▸ HDAC10 known ✓ Q969S8 1/20 0.52
▸ HDAC11 known ✓ Q96DB2 1/20 0.52
▸ HDAC8 known ✓ Q9BY41 1/20 0.52
▸ HDAC6 known ✓ Q9UBN7 1/20 0.52
▸ HDAC9 known ✓ Q9UKV0 1/20 0.52
▸ HDAC5 known ✓ Q9UQL6 1/20 0.52
▸ GAA known ✓ P10253 1/20 0.45
▸ PARP1 known ✓ P09874 1/20 0.42
▸ NFKB1 P19838 2/20 0.60
▸ CA1 P00915 1/20 0.60
▸ CA4 P22748 1/20 0.60
▸ TNKS O95271 1/20 0.52
▸ HCAR2 Q8TDS4 1/20 0.52
▸ TNKS2 Q9H2K2 1/20 0.52

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 SCHEMBL27984871 1.00 NFKB1 (0.60) NFKB1CA1CA2CA4HDAC3
SCHEMBL613719 0.98 NFKB1 (0.62) NFKB1CA1CA2CA4HDAC3
SCHEMBL1000978 0.98 NFKB1 (0.62) NFKB1CA1CA2CA4HDAC3
SCHEMBL613718 0.98 NFKB1 (0.62) NFKB1CA1CA2CA4HDAC3
SCHEMBL30686188 0.98 NFKB1 (0.62) NFKB1CA1CA2CA4HDAC3
Biphenyl SCHEMBL11848100 0.92 CA1 (0.56) NFKB1CA1CA2CA4HDAC3
Hydrochloric Acid SCHEMBL8374050 0.85 NFKB1 (0.72) NFKB1CA1CA2CA4HDAC3
SCHEMBL181650 0.83 NFE2L2 (0.61) NFKB1CA1CA2CA4HDAC1
SCHEMBL8973583 0.83 CA1 (0.55) NFKB1CA1CA2CA4HDAC3
Hydrochloric Acid SCHEMBL11214216 0.83 CA1 (0.55) NFKB1CA1CA2CA4HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107001839-B Particles for electrophoretic displays 默克专利股份有限公司 2021-01-15 — — CN disclosed
CN-107108818-B Particles for electrophoretic displays 默克专利股份有限公司 2021-01-01 — — CN disclosed
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