Hydrochloric Acid

Hydrochloric Acid

SCHEMBL562848

Cl.NNC(=O)CCCc1ccccc1N1C(=O)C=CC1=O

nearest known ligand 0.50

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
HSP90AA1 known ✓ P07900 1/20 0.38
GAA known ✓ P10253 1/20 0.37
HDAC3 known ✓ O15379 1/20 0.35
HDAC1 known ✓ Q13547 1/20 0.35
HDAC2 known ✓ Q92769 1/20 0.35
HDAC8 known ✓ Q9BY41 1/20 0.35
HDAC6 known ✓ Q9UBN7 1/20 0.35
HDAC5 known ✓ Q9UQL6 1/20 0.35
MGLL Q99685 9/20 0.50
TLR9 Q9NR96 2/20 0.42
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
ALDH1A1 P00352 2/20 0.38
PKM P14618 1/20 0.38
CCR6 P51684 1/20 0.38
ATM Q13315 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL722567 0.99 MGLL (0.51) MGLLTLR9CYP1A2CYP3A4CYP2D6
SCHEMBL487779 0.81 MGLL (0.57) MGLLTLR9ALDH1A1HSP90AA1PKM
SCHEMBL28418862 0.76 MGLL (0.54) MGLLTLR9ALDH1A1HSP90AA1PKM
SCHEMBL8352899 0.75 MGLL (0.77) MGLLTLR9ALDH1A1HSP90AA1PKM
Hydrochloric Acid SCHEMBL443354 0.75 MGLL (0.52) MGLLALDH1A1HSP90AA1PKMNPSR1
Hydrochloric Acid SCHEMBL44524 0.75 MGLL (0.52) MGLLALDH1A1HSP90AA1PKMNPSR1
SCHEMBL8612834 0.74 MGLL (0.59) MGLLTLR9ALDH1A1HSP90AA1PKM
SCHEMBL44044 0.73 MGLL (0.54) MGLLALDH1A1HSP90AA1PKMNPSR1
SCHEMBL3873448 0.73 MGLL (0.73) MGLLTLR9ALDH1A1NR1H2NR1H3
SCHEMBL3879458 0.72 MGLL (0.71) MGLLTLR9ALDH1A1NR1H2NR1H3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11981752-B2 Tumor associated monocyte/macrophage binding peptide and methods of use thereof Sanford Burnham Prebys Medical Discovery Institute (US) 2024-05-14 US disclosed
US-20240150397-A1 TARGETED DELIVERY SYSTEM AND METHODS OF USE THEREFOR Sanford Burnham Prebys Medical Discovery Institute 2024-05-09 US disclosed
US-20230173097-A1 METHODS AND COMPOSITIONS RELATED TO PEPTIDES AND PROTEINS WITH C-TERMINAL ELEMENTS SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE 2023-06-08 US disclosed
EP-2250278-B1 METHODS AND COMPOSITIONS RELATED TO PEPTIDES AND PROTEINS WITH C-TERMINAL ELEMENTS BURNHAM INSTITUTE FOR MEDICAL RES (US) 2023-04-05 EP disclosed
US-11458212-B2 Molecular imaging of cancer cells in vivo H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2022-10-04 US disclosed
US-20220175941-A1 METHODS AND COMPOSITIONS USING PEPTIDES AND PROTEINS WITH C-TERMINAL ELEMENTS SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE 2022-06-09 US disclosed
US-20220119450-A1 BI-SPECIFIC EXTRACELLULAR MATRIX BINDING PEPTIDES AND METHODS OF USE THEREOF UNIVERSITY OF TARTU (EE) 2022-04-21 US disclosed
US-11260133-B2 Methods and compositions related to peptides and proteins with C-terminal elements SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2022-03-01 US disclosed
EP-3921329-A1 BI-SPECIFIC EXTRACELLULAR MATRIX BINDING PEPTIDES AND METHODS OF USE THEREOF University of Tartu (EE) 2021-12-15 EP disclosed
US-11077212-B2 Molecular imaging of cancer cells in vivo H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2021-08-03 US disclosed
US-20090029924-A1 Targeting Host Proteinases as a Therapeutic Strategy Against Viral and Bacterial Pathogens NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2009-01-29 US disclosed
EP-1996607-A2 LYMPHATIC ZIP CODES IN TUMORS AND PRE-MALIGNANT LESIONS The Burnham Institute for Medical Research (US) 2008-12-03 EP disclosed
EP-1966234-A2 ENDOMETRIOSIS CELL TARGETING PEPTIDES AND USES THEREOF The Burnham Institute for Medical Research (US) 2008-09-10 EP disclosed
WO-2008054726-A2 TARGETING NBS1-ATM INTERACTION TO SENSITIZE CANCER CELLS TO RADIOTHERAPY AND CHEMOTHERAPY SOUTHERN RESEARCH INSTITUTE (US) 2008-05-08 WO disclosed
US-7332277-B2 Methods for detection of genetic disorders RAVGEN, INC. (US) 2008-02-19 US disclosed
US-20080008650-A1 ENDOMETRIOSIS CELL TARGETING PEPTIDE AND USES THEREOF Sanford Burnham Prebys Medical Discovery Institute 2008-01-10 US disclosed
US-20070219134-A1 LYMPHATIC ZIP CODES IN TUMORS AND PRE-MALIGNANT LESIONS THE BURNHAM INSTITUTE FOR MEDICAL RESEARCH 2007-09-20 US disclosed
WO-2007090194-A2 LYMPHATIC ZIP CODES IN TUMORS AND PRE-MALIGNANT LESIONS THE BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2007-08-09 WO disclosed
WO-2007076501-A2 ENDOMETRIOSIS CELL TARGETING PEPTIDE AND USES THEREOF THE BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2007-07-05 WO disclosed
US-20070122835-A1 Methods for detection of genetic disorders RAVGEN, INC. 2007-05-31 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 (5 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-11458212-B2 Molecular imaging of cancer cells in vivo MKI67, ANXA4, ANXA3 HSP90AA1 1516/4885GAA 2505/4885HDAC3 2758/4885
US-11260133-B2 Methods and compositions related to peptides and proteins with C-terminal elements CD2BP2, CLTC, CLTA HSP90AA1 1267/4885GAA 1895/4885HDAC3 4278/4885
US-20080008650-A1 ENDOMETRIOSIS CELL TARGETING PEPTIDE AND USES THEREOF ESR2, PROKR1, CXCL12 HSP90AA1 2575/4885GAA 4246/4885HDAC3 3772/4885
US-20070219134-A1 LYMPHATIC ZIP CODES IN TUMORS AND PRE-MALIGNANT LESIONS SLC39A3, SLC39A11, CCL2 HSP90AA1 690/4885GAA 1679/4885HDAC3 2950/4885
US-20090029924-A1 Targeting Host Proteinases as a Therapeutic Strategy Against Viral and Bacterial Pathogens SERPINB1, TMPRSS15, HPN HSP90AA1 1316/4885GAA 493/4885HDAC3 2031/4885

“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.