Hydrochloric Acid

Hydrochloric Acid

SCHEMBL2008283

CCC(C(=O)O)c1ccccc1.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 18)

geneUniProtsupporting neighboursconfidence
KCNQ2 known ✓ O43526 2/20 0.51
GAA known ✓ P10253 2/20 0.50
HTR1A known ✓ P08908 1/20 0.50
ADRA1A known ✓ P35348 1/20 0.50
BCHE known ✓ P06276 1/20 0.50
LMNA P02545 3/20 0.58
HSD17B10 Q99714 1/20 0.58
CYP2C19 P33261 1/20 0.55
ALDH1A1 P00352 1/20 0.53
POLB P06746 1/20 0.53
CRHBP P24387 2/20 0.51
CRHR2 Q13324 2/20 0.51
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
KDM4A O75164 1/20 0.50
MAPT P10636 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50

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 SCHEMBL16820451 1.00 LMNA (0.58) LMNAHSD17B10CYP2C19ALDH1A1POLB
Hydrochloric Acid SCHEMBL6911757 0.98 LMNA (0.56) LMNAHSD17B10CYP2C19ALDH1A1POLB
SCHEMBL67237 0.98 LMNA (0.59) LMNAHSD17B10CYP2C19ALDH1A1POLB
SCHEMBL20769804 0.98 LMNA (0.59) LMNAHSD17B10CYP2C19ALDH1A1POLB
SCHEMBL1715 0.98 LMNA (0.59) LMNAHSD17B10CYP2C19ALDH1A1POLB
SCHEMBL65737 0.98 LMNA (0.59) LMNAHSD17B10CYP2C19ALDH1A1POLB
SCHEMBL29757088 0.98 LMNA (0.59) LMNAHSD17B10CYP2C19ALDH1A1POLB
SCHEMBL9171150 0.96 LMNA (0.58) LMNAHSD17B10CYP2C19ALDH1A1POLB
SCHEMBL5598361 0.96 LMNA (0.58) LMNAHSD17B10CYP2C19ALDH1A1POLB
Methane SCHEMBL7338694 0.96 LMNA (0.58) LMNAHSD17B10CYP2C19ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023219156-A1 METHOD FOR PRODUCING AMINO ACID AND PEPTIDE COMPOUND, USING ENZYME AND ADDITIVE 中外製薬株式会社 2023-11-16 WO disclosed
WO-2023127752-A1 POLYPEPTIDE AND METHOD FOR PRODUCING AMINO ACID USING SAME 中外製薬株式会社 2023-07-06 WO disclosed
CN-107188808-A A kind of synthetic method of the phenylbutyric acid hydrochloride of 4 amino 3 江苏斯威森生物医药工程研究中心有限公司 2017-09-22 CN disclosed
CN-107188808-A A kind of synthetic method of the phenylbutyric acid hydrochloride of 4 amino 3 江苏斯威森生物医药工程研究中心有限公司 2017-09-22 CN disclosed
CN-107188808-A A kind of synthetic method of the phenylbutyric acid hydrochloride of 4 amino 3 江苏斯威森生物医药工程研究中心有限公司 2017-09-22 CN disclosed
CN-206417438-U A kind of hydrochloric acid tank for being used to prepare the phenylbutyric acid hydrochloride of 4 amino 3 浙江邦成化工有限公司 2017-08-18 CN disclosed
CN-206417438-U A kind of hydrochloric acid tank for being used to prepare the phenylbutyric acid hydrochloride of 4 amino 3 浙江邦成化工有限公司 2017-08-18 CN disclosed
US-9617212-B2 Isoindolin-1-ones as macrophage migration inhibitory factor (MIF) inhibitors CONTROLLED CHEMICALS, INC. (US) 2017-04-11 US disclosed
WO-2015095052-A1 ISOINDOLIN-1-ONES AS MACROPHAGE MIGRATION INHIBITORY FACTOR (MIF) INHIBITORS CONTROLLED CHEMICALS, INC. (US) 2015-06-25 WO disclosed
US-20150175540-A1 ISOINDOLIN-1-ONES AS MACROPHAGE MIGRATION INHIBITORY FACTOR (MIF) INHIBITORS CONTROLLED CHEMICALS, INC. (US) 2015-06-25 US disclosed
US-6043397-A REACTING AN AROMATIC COMPOUND HAVING CARBONYL HALIDE, ALDEHYDE OR KETONE GROUPS, AND OPTIONALLY HALOGEN GROUPS WITH A DI(ALKYL/PHENYL)AMINOSULFUR TRIFLUORIDE; REACTION CAN PROCEED IN STANDARD VESSEL AT AMBIENT TEMPERATURE, PRESSURE NIPPON SHOKUBAI CO., LTD. (JP) 2000-03-28 US disclosed
CN-1041309-C Piperiding derivatives LILLY CO ELI (US) 1998-12-23 CN disclosed
CN-1065455-A Piperidine derivative LILLY CO ELI (US) 1992-10-21 CN disclosed
US-4478837-A HYPOTENSIVE AGENTS SANDOZ LTD. (CH) 1984-10-23 US disclosed
US-4395410-A Quaternary ammonium antiarrhythmic drugs ELI LILLY AND COMPANY (US) 1983-07-26 US disclosed
EP-0002604-B1 QUATERNARY AMMONIUM SALTS, AND THEIR FORMULATIONS AND PREPARATION ELI LILLY AND COMPANY (US) 1983-05-04 EP disclosed
US-4289787-A PROLONG ACTION POTENTIAL OF CARDIAC TISSUE ELI LILLY AND COMPANY (US) 1981-09-15 US disclosed
EP-0002604-A1 Quaternary ammonium salts, and their formulations and preparation ELI LILLY AND COMPANY (US) 1979-06-27 EP disclosed
US-4140770-A Benzoylethers and processes for their production A. NATTERMANN & CIE. GMBH (DE) 1979-02-20 US disclosed
US-3954754-A ANTIHYPERTENSIVES SANDOZ LTD. (CH) 1976-05-04 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 (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-20150175540-A1 ISOINDOLIN-1-ONES AS MACROPHAGE MIGRATION INHIBITORY FACTOR (MIF) INHIBITORS MIF, MACF1, MYADM KCNQ2 4316/4885GAA 3343/4885HTR1A 3836/4885

“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.