Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6943796

Cc1cc(C)n(C(=N)N)n1.Cl

nearest known ligand 0.47

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
TSHR P16473 1/20 0.47
ENPP3 O14638 5/20 0.46
ALPL P05186 5/20 0.46
XIAP P98170 5/20 0.46
ALDH1A1 P00352 4/20 0.46
MEN1 O00255 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
KMT2A Q03164 1/20 0.46
MAPK1 P28482 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
KDM4E B2RXH2 1/20 0.43
NOS1 P29475 1/20 0.42
UBE2T Q9NPD8 1/20 0.41
POLB P06746 1/20 0.41
F12 P00748 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
SCHEMBL369236 0.98 TSHR (0.48) TSHRENPP3ALPLXIAPALDH1A1
Acetic Acid SCHEMBL10353741 0.89 TSHR (0.50) TSHRENPP3ALPLXIAPALDH1A1
Nitric Acid SCHEMBL637677 0.86 NPC1 (0.48) TSHRENPP3ALPLXIAPALDH1A1
Nitric Acid SCHEMBL28996492 0.84 NPC1 (0.47) TSHRENPP3ALPLXIAPALDH1A1
Hydrochloric Acid SCHEMBL9124540 0.82 ALDH1A1 (0.49) TSHRENPP3ALPLXIAPALDH1A1
SCHEMBL22622062 0.80 TSHR (0.52) TSHRENPP3ALPLXIAPALDH1A1
SCHEMBL9123767 0.79 ALDH1A1 (0.50) TSHRENPP3ALPLXIAPALDH1A1
SCHEMBL3185391 0.79 NOS1 (0.42) TSHRENPP3ALPLXIAPALDH1A1
SCHEMBL6454758 0.78 TSHR (0.50) TSHRENPP3ALPLXIAPALDH1A1
SCHEMBL15459000 0.78 TSHR (0.50) TSHRENPP3ALPLXIAPALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112121765-B Environment-friendly formaldehyde-removing activated carbon and preparation method thereof 品顾科技(苏州)有限公司 2022-08-30 CN claimed
CN-114015355-A High-viscosity anti-slip rubber asphalt waterproof coating 上海豫宏(金湖)防水科技有限公司 2022-02-08 CN claimed
CN-112111211-B Environment-friendly coating 佛山威迪科彩色装饰涂料有限公司 2021-10-22 CN claimed
US-5453514-A Diabetes YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1995-09-26 US claimed
CN-112121765-B Environment-friendly formaldehyde-removing activated carbon and preparation method thereof 品顾科技(苏州)有限公司 2022-08-30 CN disclosed
CN-114015355-A High-viscosity anti-slip rubber asphalt waterproof coating 上海豫宏(金湖)防水科技有限公司 2022-02-08 CN disclosed
CN-112111211-B Environment-friendly coating 佛山威迪科彩色装饰涂料有限公司 2021-10-22 CN disclosed
CN-112121765-A Environment-friendly formaldehyde-removing activated carbon and preparation method thereof 张艺峰 2020-12-25 CN disclosed
CN-112111211-A Environment-friendly coating 张艺峰 2020-12-22 CN disclosed
CN-105523997-A 3,5-dimethyl-1H-pyrazole-1-carboxamidine hydrochloride preparation method TIANJIN HEOWNS BIOCHEMISTRY TECH CO LTD 2016-04-27 CN disclosed
CN-105523997-A 3,5-dimethyl-1H-pyrazole-1-carboxamidine hydrochloride preparation method TIANJIN HEOWNS BIOCHEMISTRY TECH CO LTD 2016-04-27 CN disclosed
EP-1197486-B1 Process for the preparation of 1H-pyrazole-1-carboxamidines DEGUSSA (DE) 2003-10-15 EP disclosed
US-6410745-B1 REACTION OF PYRAZOLE OR A DERIVATIVE THEREOF WITH CYANAMIDE OR A DERIVATIVE THEREOF AND GASEOUS HYDROGEN CHLORIDE OR HYDROGEN BROMIDE IN AN APROTIC SOLVENT. DEGUSSA AG (DE) 2002-06-25 US disclosed
US-20020045762-A1 PROCESS FOR PREPARING 1-GUANYLPYRAZOLE ACID ADDUCTS DEGUSSA AG (DE) 2002-04-18 US disclosed
EP-1197486-A1 Process for the preparation of 1H-pyrazole-1-carboxamidines Degussa AG (DE) 2002-04-17 EP disclosed
US-5814580-A FORMING A CHELATE DYE BY THE REACTION OF AN AZOMETHINE DYE WITH A METAL-ION CONTAINING COMPOUND; EXCELLENT LIGHT FASTNESS KONICA CORPORATION (JP) 1998-09-29 US disclosed
EP-0732220-A1 Thermal transfer recording material KONICA CORPORATION (JP) 1996-09-18 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 (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-20020045762-A1 PROCESS FOR PREPARING 1-GUANYLPYRAZOLE ACID ADDUCTS GLRA1, CYC1, CBR3 TSHR 2206/4885ENPP3 2663/4885ALPL 4718/4885

“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.