Hydrochloric Acid

Hydrochloric Acid

SCHEMBL1762334

Cl.c1ccc2c(CCO[C@@H]3CCC[C@H]3N3CCOCC3)cccc2c1

nearest known ligand 0.93

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 15)

geneUniProtsupporting neighboursconfidence
▸ KCNA5 known ✓ P22460 4/20 0.93
▸ SCN5A known ✓ Q14524 4/20 0.93
▸ SLC18A2 known ✓ Q05940 1/20 0.43
▸ SIGMAR1 known ✓ Q99720 4/20 0.41
▸ GAA known ✓ P10253 1/20 0.38
▸ SLC6A2 known ✓ P23975 1/20 0.37
▸ SLC6A4 known ✓ P31645 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ ABCB1 P08183 1/20 0.37

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 SCHEMBL1762369 1.00 KCNA5 (0.93) KCNA5SCN5ASLC18A2SIGMAR1L3MBTL1
SCHEMBL3612928 0.99 KCNA5 (0.95) KCNA5SCN5ASLC18A2SIGMAR1L3MBTL1
SCHEMBL6445899 0.99 KCNA5 (0.95) KCNA5SCN5ASLC18A2SIGMAR1L3MBTL1
SCHEMBL2624914 0.97 KCNA5 (1.00) KCNA5SCN5ASLC18A2SIGMAR1L3MBTL1
SCHEMBL6807137 0.97 KCNA5 (1.00) KCNA5SCN5ASLC18A2SIGMAR1L3MBTL1
SCHEMBL12391697 0.97 KCNA5 (1.00) KCNA5SCN5ASLC18A2SIGMAR1L3MBTL1
SCHEMBL2625053 0.87 KCNA5 (0.82) KCNA5SCN5ASLC18A2SIGMAR1
SCHEMBL12203898 0.87 KCNA5 (0.82) KCNA5SCN5ASLC18A2SIGMAR1
Hydrochloric Acid SCHEMBL909031 0.81 KCNA5 (0.70) KCNA5SCN5AL3MBTL1KDM4EALDH1A1
Hydrochloric Acid SCHEMBL909033 0.81 KCNA5 (0.70) KCNA5SCN5AL3MBTL1KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8207219-B2 Ion channel modulating activity I CARDIOME PHARMA CORP. (CA) 2012-06-26 — — US disclosed
US-8188140-B2 Uses of ion channel modulating compounds CARDIOME PHARMA CORP. 2012-05-29 — — US disclosed
US-20120095073-A1 ION CHANNEL MODULATING ACTIVITY II CARDIOME PHARMA CORP. (CA) 2012-04-19 — — US disclosed
US-20110118329-A1 USES OF ION CHANNEL MODULATING COMPOUNDS CARDIOME PHARMA CORP. (CA) 2011-05-19 — — US disclosed
US-7820712-B2 Uses of ion channel modulating compounds CARDIOME PHARMA CORP. (CA) 2010-10-26 — — US disclosed
US-20100120890-A1 ION CHANNEL MODULATING ACTIVITY I CARDIOME PHARMA CORP. (CA) 2010-05-13 — — US disclosed
US-7674820-B2 Ion channel modulating activity I CARDIOME PHARMA CORP. (CA) 2010-03-09 — — US disclosed
US-20090270478-A1 ION CHANNEL MODULATING ACTIVITY II CARDIOME PHARMA CORP. (CA) 2009-10-29 — — US disclosed
US-7507545-B2 Ion channel modulating activity method CARDIOME PHARMA CORP. (CA) 2009-03-24 — — US disclosed
US-20090041841-A1 CONTROLLED RELEASE TABLET FORMULATIONS FOR THE PREVENTION OF ARRHYTHMIAS CARDIOME PHARMA CORP. (CA) 2009-02-12 — — US disclosed
US-20080188547-A1 USES OF ION CHANNEL MODULATING COMPOUNDS CARDIOME PHARMA CORP. (CA) 2008-08-07 — — US disclosed
US-7345086-B2 Uses of ion channel modulating compounds CARDIOME PHARMA CORP. (CA) 2008-03-18 — — US disclosed
US-20060199848-A9 Cardiovascular disorders; antiarrhythmai agenst; sodium channel moderators; potassium channel moderators; prevent fibrillation CARDIOME PHARMA CORP. (CA) 2006-09-07 — — US disclosed
US-20060135536-A9 Ion channel modulating activity I CARDIOME PHARMA CORP. (CA) 2006-06-22 — — US disclosed
US-20050119315-A1 Ion channel modulating activity II CARDIOME PHARMA CORP. (CA) 2005-06-02 — — US disclosed
US-20050070552-A1 Ion channel modulating activity I CARDIOME PHARMA CORP. (CA) 2005-03-31 — — US disclosed
US-20050026993-A1 Uses of ion channel modulating compounds CORREVIO CANADA CORP. (CA) 2005-02-03 — — US 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 (11 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-20090041841-A1 CONTROLLED RELEASE TABLET FORMULATIONS FOR THE PREVENTION OF ARRHYTHMIAS KCNN3, KCNN2, KCNN1 KCNA5 78/4885SCN5A 59/4885SLC18A2 154/4885
US-20050119315-A1 Ion channel modulating activity II KCNH1, KCNN3, KCNJ2 KCNA5 34/4885SCN5A 64/4885SLC18A2 281/4885
US-20050070552-A1 Ion channel modulating activity I KCNN1, KCNN3, KCNH1 KCNA5 45/4885SCN5A 71/4885SLC18A2 286/4885
US-20050026993-A1 Uses of ion channel modulating compounds KCNN1, KCNN2, KCNN3 KCNA5 48/4885SCN5A 49/4885SLC18A2 316/4885
US-20100120890-A1 ION CHANNEL MODULATING ACTIVITY I KCNN1, KCNN3, KCNH1 KCNA5 45/4885SCN5A 71/4885SLC18A2 286/4885
US-20060199848-A9 Cardiovascular disorders; antiarrhythmai agenst; sodium channel moderators; potassium channel moderators; prevent fibrillation KCNN3, KCNN1, KCNN2 KCNA5 40/4885SCN5A 61/4885SLC18A2 268/4885
US-20060135536-A9 Ion channel modulating activity I KCNN1, KCNN3, KCNH1 KCNA5 45/4885SCN5A 71/4885SLC18A2 286/4885
US-20090270478-A1 ION CHANNEL MODULATING ACTIVITY II KCNH1, KCNN3, KCNN2 KCNA5 31/4885SCN5A 59/4885SLC18A2 278/4885
US-20110118329-A1 USES OF ION CHANNEL MODULATING COMPOUNDS KCNN1, KCNN2, KCNN3 KCNA5 48/4885SCN5A 49/4885SLC18A2 316/4885
US-20080188547-A1 USES OF ION CHANNEL MODULATING COMPOUNDS KCNN1, KCNN2, KCNN3 KCNA5 48/4885SCN5A 49/4885SLC18A2 316/4885
US-20120095073-A1 ION CHANNEL MODULATING ACTIVITY II KCNH1, KCNN3, KCNJ2 KCNA5 34/4885SCN5A 64/4885SLC18A2 281/4885

“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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