Hydrochloric Acid

Hydrochloric Acid

SCHEMBL2536717

Cl.O=C(CCCS)NCCN(CCNC(=O)CCCS)CCNC(=O)CCCS

nearest known ligand 0.52

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 18)

geneUniProtsupporting neighboursconfidence
HDAC3 known ✓ O15379 8/20 0.40
HDAC1 known ✓ Q13547 8/20 0.40
HDAC2 known ✓ Q92769 8/20 0.40
HDAC10 known ✓ Q969S8 8/20 0.40
HDAC11 known ✓ Q96DB2 8/20 0.40
HDAC8 known ✓ Q9BY41 8/20 0.40
HDAC6 known ✓ Q9UBN7 8/20 0.40
HDAC4 known ✓ P56524 7/20 0.40
HDAC7 known ✓ Q8WUI4 7/20 0.40
HDAC9 known ✓ Q9UKV0 7/20 0.40
HDAC5 known ✓ Q9UQL6 7/20 0.40
DNM1 Q05193 2/20 0.49
FAAH O00519 3/20 0.39
TSHR P16473 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.35
CASP2 P42575 1/20 0.34

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
SCHEMBL12254769 0.84 DNM1 (0.68) DNM1HDAC3HDAC1HDAC2HDAC10
SCHEMBL3025339 0.83 HDAC3 (0.47) DNM1HDAC3HDAC1HDAC2HDAC10
SCHEMBL930496 0.81 TSHR (0.48) DNM1HDAC3HDAC1HDAC2HDAC10
SCHEMBL929719 0.81 HDAC3 (0.55) DNM1HDAC3HDAC1HDAC2HDAC10
SCHEMBL4633503 0.79 HDAC3 (0.49) DNM1HDAC3HDAC1HDAC2HDAC10
SCHEMBL15445157 0.77 CA1 (0.39) DNM1HDAC3HDAC1HDAC2HDAC10
SCHEMBL6515149 0.77 DNM1 (0.35) DNM1HDAC3HDAC1HDAC2HDAC10
SCHEMBL9649999 0.77 CNR1 (0.47) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL12231859 0.75 HDAC3 (0.42) DNM1HDAC3HDAC1HDAC2HDAC10
SCHEMBL12605287 0.75 CNR1 (0.47) DNM1HDAC3HDAC1HDAC2HDAC10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8044172-B2 Barrier membrane STRAUMANN HOLDING AG (CH) 2011-10-25 US disclosed
US-7741427-B2 Barrier membrane STRAUMANN HOLDING AG (CH) 2010-06-22 US disclosed
US-20100105800-A1 BARRIER MEMBRANE STRAUMANN HOLDING AG (CH) 2010-04-29 US disclosed
US-20080039577-A1 Kit for preparing a cell-occlusive membrane containing acrylated ethylene oxide adduct of a glycerol oligomer and a mercaptopropyl endcapped ethylene oxide pentaerythritol adduct; biodegradable membrane for use in surgury; provides a barrier to allow complete healing time for effective bone regeneration STRAUMANN HOLDING AG (CH) 2008-02-14 US disclosed
EP-1609491-B1 Barrier membrane STRAUMANN HOLDING AG (CH) 2008-02-06 EP disclosed
WO-2005123156-A1 BARRIER MEMBRANE STRAUMANN HOLDING AG (CH) 2005-12-29 WO disclosed
EP-1609491-A1 Barrier membrane Straumann Holding AG (CH) 2005-12-28 EP 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-20080039577-A1 Kit for preparing a cell-occlusive membrane containing acrylated ethylene oxide adduct of a glycerol oligomer and a mercaptopropyl endcapped ethylene oxide pentaerythritol adduct; biodegradable membrane for use in surgury; provides a barrier to allow complete healing time for effective bone regeneration KIT, PCNA, OGG1 HDAC3 4699/4885HDAC1 4532/4885HDAC2 4755/4885

“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.