Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4170160

Cl.N=C(NO)c1cc(O)c(O)c(O)c1

nearest known ligand 0.41

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 0.41
DPP4 known ✓ P27487 1/20 0.41
GAA known ✓ P10253 2/20 0.40
TOP1 known ✓ P11387 3/20 0.38
TOP2A known ✓ P11388 3/20 0.38
TOP2B known ✓ Q02880 3/20 0.38
EGFR known ✓ P00533 2/20 0.34
HDAC6 known ✓ Q9UBN7 1/20 0.34
KDM4E B2RXH2 3/20 0.41
LMNA P02545 3/20 0.41
TDP1 Q9NUW8 3/20 0.41
SNCA P37840 3/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
FUT7 Q11130 2/20 0.41
SELL P14151 2/20 0.41
SELP P16109 2/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL4168980 0.98 KDM4E (0.42) KDM4ELMNATDP1SNCAALDH1A1
SCHEMBL13924923 0.80 PTGS2 (0.55) KDM4ELMNATDP1FUT7CA12
SCHEMBL12348318 0.79 HDAC8 (0.30) HDAC6
SCHEMBL3237538 0.76 TTR (0.48) LMNATDP1ALDH1A1MAPTCA1
SCHEMBL8121970 0.74 TTR (0.46) KDM4ELMNAALDH1A1MAPTHPGD
SCHEMBL6377504 0.74 HDAC6 (0.57) KDM4ESNCAMAPTCA12CA1
SCHEMBL261652 0.74 CA1 (0.44) ALDH1A1CA1CA2GAAL3MBTL1
SCHEMBL261538 0.70 GABRA1 (0.40) ALDH1A1
SCHEMBL20580082 0.70 SNCA (0.46) KDM4ELMNASNCAHSD17B10HDAC6
SCHEMBL16706131 0.68 PRSS1 (0.37) HDAC6

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-20170100352-A1 Methods for treating or preventing neuroinflammation or autoimmune diseases ELFORD HOWARD L (US) 2017-04-13 US disclosed
US-9526707-B2 Methods for treating or preventing neuroinflammation or autoimmune diseases ELFORD HOWARD L (US) 2016-12-27 US disclosed
EP-2030615-A2 Ribonucleotide reductase inhibitors for use in the treatment or prevention of neuroinflammatory or autoimmune diseases ELFORD, Howard L. (US) 2009-03-04 EP disclosed
US-20090047250-A1 Methods for treating or preventing neuroinflammation or autoimmune diseases ELFORD HOWARD L 2009-02-19 US disclosed
US-20060154892-A1 Procedure to block the replication of reverse transcriptase dependent viruses by the use of inhibitors of deoxynucleotides synthesis LORI FRANCO 2006-07-13 US disclosed
US-20060052317-A1 Procedure to block the replication of reverse transcriptase dependent viruses by the use of inhibitors of deoxynucleotides synthesis LORI FRANCO 2006-03-09 US disclosed
US-20030095988-A1 Method of inducing autovaccination against HIV infection using structured treatment interruptions LISZIEWICZ JULIANNA (US) 2003-05-22 US disclosed
WO-2002095005-A2 THERAPEUTIC DNA VACCINATION LISZIEWICZ JULIANNA (US) 2002-11-28 WO disclosed
US-20020022034-A1 Antiretroviral therapy LISZIEWICZ JULIANNA (US) 2002-02-21 US disclosed
US-20010008905-A1 Procedure to block the replication of reverse transcriptase dependent viruses by the use of inhibitors of deoxynucleotides synthesis LORI FRANCO (IT) 2001-07-19 US disclosed
US-6251874-B1 IF HIV VIRAL LOAD IN BLOOD OF PATIENT IS ABOVE SPECIFIED AMOUNT, ADMINISTERING HYDROXYUREA, DIDEOXYINOSINE AND INDINAVIR UNTIL VIRAL LOAD IS REDUCED; IF VIRAL LOAD IS BELOW THAT SPECIFIED, ADMINISTERING HYDROXYUREA AND DIDEOXYINOSINE RESEARCH INSTITUTE FOR GENETIC AND HUMAN THERAPY (R.I.G.H.T.) 2001-06-26 US disclosed
US-6194390-B1 ADMINISTERING HYDROXYUREA AND A 2'-FLUOROPURINE-DIDEOXY-NUCLEOSIDE SELECTED FROM THE GROUP OF 2'-FLUORO-2',3'-DIDE-OXYADENOSINE,-DIDEOXYINOSINE, AND -DIDEOXYGUANOSINE WITH A CARRIER OR EXCIPIENT; VIRICIDES; RETROVIRUSES; PLANT VIRUSES THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES 2001-02-27 US disclosed
US-6114312-A SYNERGISTIC MIXTURE; PREVENTIO REPLICATION OF REVERSE TRANSCRIPTASE VIRUS RESEARCH INSTITUTE FOR GENETIC AND HUMAN THERAPY (R.I.G.H.T.) (US) 2000-09-05 US disclosed
US-5977086-A Method of inhibiting human immunodeficiency virus by combined use of hydroxyurea, a nucleoside analog, and a protease inhibitor R.I.G.H.T. (US) 1999-11-02 US disclosed
US-5350770-A Administering hydroxy benzamide derivative ELFORD HOWARD L (US) 1994-09-27 US disclosed
WO-1994002135-A1 THERAPEUTIC PROCESS FOR THE TREATMENT OF SEPTIC SHOCK ELFORD HOWARD L (US) 1994-02-03 WO 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 (2 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-20090047250-A1 Methods for treating or preventing neuroinflammation or autoimmune diseases RNASE1, RNASEH1, TXNRD3 CA2 3757/4885DPP4 1052/4885GAA 1275/4885
US-20170100352-A1 Methods for treating or preventing neuroinflammation or autoimmune diseases RNASE1, RNASEH1, TXNRD3 CA2 3757/4885DPP4 1052/4885GAA 1275/4885

“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.