Hydrochloric Acid

Hydrochloric Acid

SCHEMBL17309873

CC(C)(C)OC(=O)NC(CCCCN)C(=O)OC(C)(C)C.Cl

nearest known ligand 0.48

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 19)

geneUniProtsupporting neighboursconfidence
ITGB3 known ✓ P05106 8/20 0.47
ITGA2B known ✓ P08514 8/20 0.47
HDAC4 known ✓ P56524 2/20 0.43
HDAC1 known ✓ Q13547 2/20 0.43
HDAC6 known ✓ Q9UBN7 1/20 0.43
CTSK P43235 4/20 0.48
CTSS P25774 3/20 0.46
TDP1 Q9NUW8 3/20 0.44
ATM Q13315 1/20 0.44
MEN1 O00255 1/20 0.42
POLB P06746 1/20 0.42
KMT2A Q03164 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
P2RY2 P41231 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
HTT P42858 1/20 0.41
MAPT P10636 1/20 0.40

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 SCHEMBL8376069 1.00 CTSK (0.48) CTSKITGB3ITGA2BCTSSTDP1
SCHEMBL1304236 0.98 CTSK (0.49) CTSKITGB3ITGA2BCTSSTDP1
SCHEMBL7150850 0.98 CTSK (0.49) CTSKITGB3ITGA2BCTSSTDP1
SCHEMBL23608150 0.98 CTSK (0.49) CTSKITGB3ITGA2BCTSSTDP1
SCHEMBL30361337 0.97 CTSK (0.48) CTSKITGB3ITGA2BCTSSTDP1
Hydrochloric Acid SCHEMBL6809172 0.95 CTSK (0.49) CTSKITGB3ITGA2BCTSSTDP1
Hydrochloric Acid SCHEMBL13736640 0.95 CTSK (0.49) CTSKITGB3ITGA2BCTSSTDP1
Acetic Acid SCHEMBL11204426 0.94 ITGB3 (0.48) CTSKITGB3ITGA2BCTSSTDP1
SCHEMBL3697925 0.94 CTSK (0.50) CTSKITGB3ITGA2BCTSSTDP1
SCHEMBL17603548 0.94 CTSK (0.50) CTSKITGB3ITGA2BCTSSTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-121318852-A Preparation method and application of myogastric erosive agent 河南省农业科学院 2026-01-13 CN disclosed
CN-110250594-B Health-care magnet underpants 重庆蒙特莱蒂服装有限责任公司 2021-04-20 CN disclosed
CN-108706654-B Efficient composite water treatment agent and preparation method thereof 武汉格林环保设施运营有限责任公司 2020-08-04 CN disclosed
CN-110250594-A Health-care magnet underpants 尹淑珍 2019-09-20 CN disclosed
CN-109641878-A DIPROVOCIM: a new class of effective TLR agonist 斯克里普斯研究学院 2019-04-16 CN disclosed
CN-108883195-A Prodrugs of cytotoxic active substances with enzymatically cleavable groups 拜耳制药股份公司 2018-11-23 CN disclosed
CN-107987081-A A kind of new chlorin e 6 derivative and its pharmaceutically acceptable salt, its preparation method and application 刘辉 2018-05-04 CN disclosed
CN-104981456-B The manufacture method of desmosine, isodensmosine and their derivative 学校法人上智学院 2017-12-19 CN disclosed
EP-2952504-B1 METHOD FOR PRODUCING DESMOSINE, ISODESMOSINE AND DERIVATIVES THEREOF SOPHIA SCHOOL CORP (JP) 2017-10-11 EP disclosed
US-9556119-B2 Process for preparing desmosine, isodesmosine, and derivatives thereof SOPHIA SCHOOL CORPORATION (JP) 2017-01-31 US disclosed
US-20150376127-A1 PROCESS FOR PREPARING DESMOSINE, ISODESMOSINE, AND DERIVATIVES THEREOF SOPHIA SCHOOL CORPORATION (JP) 2015-12-31 US disclosed
EP-2952504-A1 METHOD FOR PRODUCING DESMOSINE, ISODESMOSINE AND DERIVATIVES THEREOF Sophia School Corporation (JP) 2015-12-09 EP disclosed
CN-104981456-A Method for producing desmosine, isodesmosine and derivatives thereof SOPHIA SCHOOL CORP 2015-10-14 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-20150376127-A1 PROCESS FOR PREPARING DESMOSINE, ISODESMOSINE, AND DERIVATIVES THEREOF SI, SMS, SRM ITGB3 3166/4885ITGA2B 4002/4885HDAC4 3543/4885

“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.