Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4810986

COC(=O)[C@]1(N)CC[C@H]2[C@H](C(=O)O)[C@H]21.Cl

nearest known ligand 0.66

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 10)

geneUniProtsupporting neighboursconfidence
SLC1A2 P43004 1/20 0.66
SLC1A1 P43005 1/20 0.66
GRM2 Q14416 12/20 0.65
GRM3 Q14832 12/20 0.65
GRM6 O15303 8/20 0.65
GRM8 O00222 5/20 0.65
GRM4 Q14833 1/20 0.36
PPM1B O75688 1/20 0.33
PTPN1 P18031 1/20 0.33
PPP1CC P36873 1/20 0.33

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 SCHEMBL4810967 0.87 SLC1A2 (0.49) SLC1A2SLC1A1GRM2GRM3GRM6
SCHEMBL7124212 0.85 SLC1A2 (0.50) SLC1A2SLC1A1GRM2GRM3GRM6
SCHEMBL4810978 0.85 SLC1A2 (0.50) SLC1A2SLC1A1GRM2GRM3GRM6
SCHEMBL30417494 0.80 SLC1A2 (1.00) SLC1A2SLC1A1GRM2GRM3GRM6
Eglumetad SCHEMBL13728495 0.79 GRM2 (1.00) SLC1A2SLC1A1GRM2GRM3GRM6
Eglumetad SCHEMBL481248 0.79 GRM2 (1.00) SLC1A2SLC1A1GRM2GRM3GRM6
Eglumetad SCHEMBL231157 0.79 GRM2 (1.00) SLC1A2SLC1A1GRM2GRM3GRM6
Eglumetad SCHEMBL13319987 0.79 GRM2 (1.00) SLC1A2SLC1A1GRM2GRM3GRM6
Eglumetad SCHEMBL15060586 0.79 GRM2 (1.00) SLC1A2SLC1A1GRM2GRM3GRM6
Eglumetad SCHEMBL16585263 0.79 GRM2 (1.00) SLC1A2SLC1A1GRM2GRM3GRM6

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-7456221-B2 Prodrugs of excitatory amino acids ELI LILLY AND COMPANY (US) 2008-11-25 US disclosed
US-20070265342-A1 2-[(2'S)-(2'-Amino)-propionyl]amino-bicyclo[3.1.0]hexane-2,6-dicarboxylic acid; glutamate receptor agonist; antidepressant, anxiolytic agent; psychological, and psychiatric disorders COFFEY DAVID S 2007-11-15 US disclosed
US-7256217-B2 Prodrugs of excitatory amino acids ELI LILLY AND COMPANY (US) 2007-08-14 US disclosed
EP-1368304-B1 PRODRUGS OF EXCITATORY AMINO ACIDS LILLY CO ELI (US) 2007-03-07 EP disclosed
US-20040121962-A1 Prodrugs of excitatory amino acids ELI LILLY AND COMPANY 2004-06-24 US disclosed
EP-1310480-A1 Prodrugs of excitatory amino acids Eli Lilly & Company (US) 2003-05-14 EP disclosed
EP-1310482-A1 Prodrugs of excitatory amino acids ELI LILLY AND COMPANY (US) 2003-05-14 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 (2 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-20070265342-A1 2-[(2'S)-(2'-Amino)-propionyl]amino-bicyclo[3.1.0]hexane-2,6-dicarboxylic acid; glutamate receptor agonist; antidepressant, anxiolytic agent; psychological, and psychiatric disorders GRIN2C, GRM2, GRIN2A SLC1A2 7/4885SLC1A1 29/4885GRM2 2/4885
US-20040121962-A1 Prodrugs of excitatory amino acids SLC1A2, SLC1A1, SLC1A3 SLC1A2 1/4885SLC1A1 2/4885GRM2 19/4885

“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.