Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4284558

CCC(C)[C@@H](N)C(=O)OC.Cl

nearest known ligand 0.43

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 7)

geneUniProtsupporting neighboursconfidence
DPP4 known ✓ P27487 12/20 0.43
CA2 known ✓ P00918 1/20 0.39
DPP8 Q6V1X1 8/20 0.43
DPP9 Q86TI2 7/20 0.43
IARS1 P41252 3/20 0.41
CA1 P00915 1/20 0.39
DPP7 Q9UHL4 7/20 0.39

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 SCHEMBL76739 1.00 DPP4 (0.43) DPP4DPP8DPP9IARS1CA1
Hydrochloric Acid SCHEMBL4284560 1.00 DPP4 (0.43) DPP4DPP8DPP9IARS1CA1
Hydrochloric Acid SCHEMBL76740 1.00 DPP4 (0.43) DPP4DPP8DPP9IARS1CA1
Hydrochloric Acid SCHEMBL5420866 1.00 DPP4 (0.43) DPP4DPP8DPP9IARS1CA1
Hydrochloric Acid SCHEMBL1599029 1.00 DPP4 (0.43) DPP4DPP8DPP9IARS1CA1
Hydrochloric Acid SCHEMBL233325 1.00 DPP4 (0.43) DPP4DPP8DPP9IARS1CA1
Hydrochloric Acid SCHEMBL31084736 1.00 DPP4 (0.43) DPP4DPP8DPP9IARS1CA1
SCHEMBL76741 0.98 DPP4 (0.44) DPP4DPP8DPP9IARS1CA1
SCHEMBL1770623 0.98 DPP4 (0.44) DPP4DPP8DPP9IARS1CA1
SCHEMBL1770627 0.98 DPP4 (0.44) DPP4DPP8DPP9IARS1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090156624-A1 Methionine aminopeptidase-2 inhibitors and methods of use thereof PRAECIS PHARMACEUTICALS INC (US) 2009-06-18 US disclosed
US-7405194-B2 Therapeutic agents and methods of use thereof for the treatment of melanoma PRAECIS PHARMACEUTICALS, INC. (US) 2008-07-29 US disclosed
EP-1503749-A4 METHIONINE AMINOPEPTIDASE-2 INHIBITORS AND METHODS OF USE THEREOF PRAECIS PHARM INC (US) 2008-04-09 EP disclosed
US-7348307-B2 Methionine aminopeptidase-2 inhibitors and methods of use thereof PRAECIS PHARMACEUTICALS INCORPORATED (US) 2008-03-25 US disclosed
WO-2008011114-A2 METHIONINE AMINOPEPTIDASE-2 INHIBITORS AND METHODS OF USE THEREOF PRAECIS PHARMACEUTICALS INCORPORATED (US) 2008-01-24 WO disclosed
US-7268111-B2 Therapeutic agents and methods of use thereof for the modulation of angiogenesis PRAECIS PHARMACEUTICALS, INC. (US) 2007-09-11 US disclosed
US-20070161570-A1 Methionine aminopeptidase-2 inhibitors and methods of use thereof PRAECIS PHARMACEUTICALS, INC. (US) 2007-07-12 US disclosed
US-20070117758-A1 Therapeutic agents and methods of use thereof for the modulation of angiogenesis PRAECIS PHARMACEUTICALS, INC. (US) 2007-05-24 US disclosed
US-20070010452-A1 Methionine aminopeptidase-2 inhibitors and methods of use thereof PRAECIS PHARMACEUTICALS, INC. (US) 2007-01-11 US disclosed
US-7157420-B2 Therapeutic agents and methods of use thereof for the modulation of angiogenesis PRAECIS PHARMACEUTICALS, INC. (US) 2007-01-02 US disclosed
US-20050130903-A1 Therapeutic agents and methods of use thereof for the modulation of angiogenesis GLAXOSMITHKLINE LLC 2005-06-16 US disclosed
US-20050059585-A1 Methionine aminopeptidase-2 inhibitors and methods of use thereof PRAECIS PHARMACEUTICALS INC. (US) 2005-03-17 US disclosed
EP-1503749-A2 METHIONINE AMINOPEPTIDASE-2 INHIBITORS AND METHODS OF USE THEREOF Praecis Pharmaceuticals Inc. (US) 2005-02-09 EP disclosed
WO-2003092608-A2 METHIONINE AMINOPEPTIDASE-2 INHIBITORS AND METHODS OF USE THEREOF PRAECIS PHARMACEUTICALS, INC. (US) 2003-11-13 WO disclosed
EP-1330447-A2 PEPTIDES AS MET-AP2 INHIBITORS Praecis Pharmaceuticals Incorporated (US) 2003-07-30 EP disclosed
US-20030109671-A1 Therapeutic agents and methods of use thereof for the modulation of angiogenesis PRAECIS PHARMACEUTICALS INC. 2003-06-12 US disclosed
US-6548477-B1 A carbamate or urea containing comopound is useful to treat angiogeneisis; methionine aminopeptidase 2 (MetAP-2) coupled to a peptide prevents the metabolic degradation of the angiogenesis inhibitor compound PRAECIS PHARMACEUTICALS INC. 2003-04-15 US disclosed
US-20020193298-A1 Therapeutic agents and methods of use thereof for the modulation of angiogenesis PRAECIS PHARMACEUTICALS INC. 2002-12-19 US disclosed
US-20020151493-A1 Therapeutic agents and methods of use thereof for the modulation of angiogenesis PRAECIS PHARMACEUTICALS INC. 2002-10-17 US disclosed
WO-2002042295-A2 PEPTIDES AS MET-AP2 INHIBITORS PRAECIS PHARMACEUTICALS INC. (US) 2002-05-30 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 (9 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-20070010452-A1 Methionine aminopeptidase-2 inhibitors and methods of use thereof METAP2, METAP1, DNPEP DPP4 104/4885CA2 597/4885DPP8 142/4885
US-20030109671-A1 Therapeutic agents and methods of use thereof for the modulation of angiogenesis METAP2, METAP1, ADM2 DPP4 573/4885CA2 896/4885DPP8 863/4885
US-20020193298-A1 Therapeutic agents and methods of use thereof for the modulation of angiogenesis METAP2, METAP1, ADM2 DPP4 573/4885CA2 896/4885DPP8 863/4885
US-20050130903-A1 Therapeutic agents and methods of use thereof for the modulation of angiogenesis METAP2, METAP1, ADM2 DPP4 573/4885CA2 896/4885DPP8 863/4885
US-20050059585-A1 Methionine aminopeptidase-2 inhibitors and methods of use thereof METAP2, METAP1, LNPEP DPP4 63/4885CA2 782/4885DPP8 89/4885
US-20070117758-A1 Therapeutic agents and methods of use thereof for the modulation of angiogenesis METAP2, METAP1, ADM2 DPP4 573/4885CA2 896/4885DPP8 863/4885
US-20020151493-A1 Therapeutic agents and methods of use thereof for the modulation of angiogenesis METAP2, METAP1, ADM2 DPP4 573/4885CA2 896/4885DPP8 863/4885
US-20070161570-A1 Methionine aminopeptidase-2 inhibitors and methods of use thereof METAP2, METAP1, LNPEP DPP4 74/4885CA2 744/4885DPP8 105/4885
US-20090156624-A1 Methionine aminopeptidase-2 inhibitors and methods of use thereof METAP2, METAP1, DNPEP DPP4 104/4885CA2 597/4885DPP8 142/4885

“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.