Hydrochloric Acid

Hydrochloric Acid

SCHEMBL1326865

CC(C)(C)c1ccc(S(=O)(=O)O)cc1.Cl

nearest known ligand 0.59

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
▸ GAA known ✓ P10253 1/20 0.52
▸ CA2 known ✓ P00918 2/20 0.47
▸ HSD11B1 known ✓ P28845 3/20 0.47
▸ DRD1 known ✓ P21728 1/20 0.46
▸ DRD3 known ✓ P35462 1/20 0.46
▸ ALDH1A1 P00352 7/20 0.59
▸ LMNA P02545 6/20 0.52
▸ UQCRB P14927 2/20 0.49
▸ TSHR P16473 3/20 0.48
▸ NT5E P21589 1/20 0.48
▸ CA1 P00915 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ TYR P14679 1/20 0.46
▸ HSD17B3 P37058 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ HSD17B2 P37059 1/20 0.46
▸ MAPT P10636 3/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ HPGD P15428 2/20 0.46

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
SCHEMBL196750 0.98 ALDH1A1 (0.61) ALDH1A1LMNAGAAUQCRBTSHR
Ammonia Solution, Strong SCHEMBL27721989 0.95 ALDH1A1 (0.59) ALDH1A1LMNAGAAUQCRBTSHR
SCHEMBL25384264 0.91 ALDH1A1 (0.55) ALDH1A1LMNAGAAUQCRBTSHR
SCHEMBL2950033 0.91 ALDH1A1 (0.55) ALDH1A1LMNAGAAUQCRBTSHR
SCHEMBL16563156 0.90 ALDH1A1 (0.50) ALDH1A1LMNAGAAUQCRBTSHR
Ammonia Solution, Strong SCHEMBL25386856 0.90 ALDH1A1 (0.53) ALDH1A1LMNAGAAUQCRBTSHR
SCHEMBL16563244 0.88 ALDH1A1 (0.53) ALDH1A1LMNAGAAUQCRBTSHR
SCHEMBL28852092 0.88 ALDH1A1 (0.52) ALDH1A1LMNAGAAUQCRBTSHR
SCHEMBL16563158 0.88 ALDH1A1 (0.52) ALDH1A1LMNAGAAUQCRBTSHR
SCHEMBL25385943 0.86 ALDH1A1 (0.50) ALDH1A1LMNAGAAUQCRBTSHR

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 43 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110218193-A 3- hydroxyquinazoline -2,4 (1H, 3H)-diketone derivative and the preparation method and application thereof 山东大学 2019-09-10 — — CN disclosed
CN-106103439-B 2,7- diaza spiro [3.5] nonane compound 瑞敏德股份有限公司 2019-03-08 — — CN disclosed
CN-107266425-A Pyrazol-1-yl benzene sulfonamides as CCR9 antagonists 坎莫森特里克斯公司 2017-10-20 — — CN disclosed
CN-104520288-B Pyrazol-1-yl benzene sulfonamides as ccr9 antagonists 坎莫森特里克斯公司 2017-05-17 — — CN disclosed
CN-106103439-A 2,7 diaza spiros [3.5] nonane compound 瑞敏德股份有限公司 2016-11-09 — — CN disclosed
CN-103476752-B Substituted aromatic series sulphur compound and using method thereof 赛福伦公司 2016-09-28 — — CN disclosed
CN-105601622-A 1-oxo/acylated-14-acylated oridonin derivative and preparation method as well as application thereof HANGZHOU BENSHENG PHARMACEUTICAL CO LTD 2016-05-25 — — CN disclosed
CN-103002735-B Modulators of 5-ht receptors and methods of use thereof ABBVI CO 2015-05-20 — — CN disclosed
CN-104168958-A Diaryl sulfonamides useful for the treatment of inflammation and cancer KANCERA AB 2014-11-26 — — CN disclosed
CN-103002735-A Modulators of 5-ht receptors and methods of use thereof ABBVI CO 2013-03-27 — — CN disclosed
CN-1867338-A Bicyclic [3.1.0] derivatives as glycine transporter inhibitors PFIZER PROD INC (US) 2006-11-22 — — CN disclosed
US-20060074084-A1 Inhibitors of soluble adenylate cyclase BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2006-04-06 — — US disclosed
CN-1678306-A -3 (sulfonamidoethyl) -indole derivaties for use as glucocorticoid mimetics in the treatment of inflammatory, allergic and proliferative diseases BOEHRINGER INGELHEIM PHARMA (US) 2005-10-05 — — CN disclosed
CN-1671386-A Substituted anilinic piperidines as MCH selective antagonists LUNDBECK & CO AS H (DK) 2005-09-21 — — CN disclosed
CN-1655780-A Thiazolidine carboxamide derivatives as modulators of the prostaglandin f receptor APPLIED RESEARCH SYSTEMS (AN) 2005-08-17 — — CN disclosed
CN-1556702-A Aminoindazole derivatives active as kinase inhibitors, process for their preparation and pharmaceutical compositions containing them — 2004-12-22 — — CN disclosed
CN-1549714-A Aminoisoxazole derivatives active as kinase inhibitors — 2004-11-24 — — CN disclosed
CN-1350452-A Preventive or therapeutic drugs for diabetes SHIONOGI & CO (JP) 2002-05-22 — — CN disclosed
CN-1295677-A Method and apparatus for accelerated orthokeratology EASTA PHARMACEUTICALS INC (US) 2001-05-16 — — CN disclosed
CN-1058880-A The sulfoneoxime ester compound of tool Fungicidally active DU PONT (US) 1992-02-26 — — CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060074084-A1 Inhibitors of soluble adenylate cyclase ADCY1, ADCY2, ADCY5 GAA 791/4885CA2 293/4885HSD11B1 562/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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