Hydrochloric Acid

Hydrochloric Acid

SCHEMBL21796041

Cl.FC(F)(F)c1cccnc1

nearest known ligand 0.55

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 11)

geneUniProtsupporting neighboursconfidence
CYP19A1 known ✓ P11511 6/20 0.55
KCNA5 known ✓ P22460 1/20 0.44
KIF11 P52732 1/20 0.55
CYP3A4 P08684 3/20 0.51
CYP3A5 P20815 3/20 0.51
NPC1 O15118 1/20 0.47
TSHR P16473 3/20 0.46
ALDH1A1 P00352 1/20 0.46
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
NPY5R Q15761 1/20 0.45

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
SCHEMBL7068828 0.98 CYP19A1 (0.57) CYP19A1KIF11CYP3A4CYP3A5NPC1
SCHEMBL13577 0.98 CYP19A1 (0.57) CYP19A1KIF11CYP3A4CYP3A5NPC1
SCHEMBL29387897 0.98 CYP19A1 (0.57) CYP19A1KIF11CYP3A4CYP3A5NPC1
Benzene SCHEMBL29164330 0.95 CYP19A1 (0.55) CYP19A1KIF11CYP3A4CYP3A5NPC1
Lithium SCHEMBL30216964 0.95 CYP19A1 (0.55) CYP19A1KIF11CYP3A4CYP3A5NPC1
Water SCHEMBL27638122 0.95 CYP3A4 (0.56) CYP19A1KIF11CYP3A4CYP3A5NPC1
Ammonia Solution, Strong SCHEMBL28655959 0.95 CYP19A1 (0.55) CYP19A1KIF11CYP3A4CYP3A5NPC1
Bromide SCHEMBL29204966 0.95 CYP19A1 (0.55) CYP19A1KIF11CYP3A4CYP3A5NPC1
Lithium Ion SCHEMBL28974295 0.93 CYP19A1 (0.53) CYP19A1KIF11CYP3A4CYP3A5NPC1
Hydrazine SCHEMBL28287990 0.93 CYP19A1 (0.53) CYP19A1KIF11CYP3A4CYP3A5NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111117594-B Electrochromic material and electrochromic device based on dynamic metal-ligand complexation 吉林大学 2024-03-26 CN disclosed
EP-4096661-A1 COMPOUNDS AND COMPOSITIONS FOR USE IN TREATING SKIN DISORDERS Kamari Pharma Ltd. (IL) 2022-12-07 EP disclosed
US-11254642-B2 Method for preparing 2-chloro-5-trifluoromethylpyridine ZHEJIANG LANTIAN ENVIRONMENTAL PROTECTION HI-TECH CO., LTD. (CN) 2022-02-22 US disclosed
US-20220002249-A1 METHOD FOR PREPARING 2,3-DICHLORO-5-TRIFLUOROMETHYLPYRIDINE WITH HIGH SELECTIVITY ZHEJIANG LANTIAN ENVIRONMENTAL PROT HI TECH CO LTD (CN) 2022-01-06 US disclosed
US-11186546-B2 Method for preparing 2,3-dichloro-5-trifluoromethylpyridine with high selectivity ZHEJIANG LANTIAN ENVIRONMENTAL PROTECTION HI-TECH CO., LTD. (CN) 2021-11-30 US disclosed
US-20200102273-A1 METHOD FOR PREPARING 2,3-DICHLORO-5-TRIFLUOROMETHYLPYRIDINE WITH HIGH SELECTIVITY Sinochem Lantian Co., Ltd. (CN) 2020-04-02 US disclosed
EP-3620451-A1 METHOD FOR PREPARING 2,3-DICHLORO-5-TRIFLUOROMETHYLPYRIDINE WITH HIGH SELECTIVITY Zhejiang Lantian Environmental Protection Hi-Tech Co., Ltd. (CN) 2020-03-11 EP disclosed
CN-105566209-A Purifying method of beta-trifluoromethylpyridine chloride ZHEJIANG CHEMICAL INST TECH CO LTD 2016-05-11 CN disclosed
CN-105566209-A Purifying method of beta-trifluoromethylpyridine chloride ZHEJIANG CHEMICAL INST TECH CO LTD 2016-05-11 CN 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 (4 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-20220002249-A1 METHOD FOR PREPARING 2,3-DICHLORO-5-TRIFLUOROMETHYLPYRIDINE WITH HIGH SELECTIVITY C2CD5, DRD4, KCND2 CYP19A1 4632/4885KCNA5 107/4885KIF11 2418/4885
US-20200102273-A1 METHOD FOR PREPARING 2,3-DICHLORO-5-TRIFLUOROMETHYLPYRIDINE WITH HIGH SELECTIVITY C2CD5, DRD4, KCND2 CYP19A1 4698/4885KCNA5 112/4885KIF11 2637/4885
US-11254642-B2 Method for preparing 2-chloro-5-trifluoromethylpyridine CACNG5, IL5, GEMIN5 CYP19A1 4336/4885KCNA5 4/4885KIF11 1125/4885
US-11186546-B2 Method for preparing 2,3-dichloro-5-trifluoromethylpyridine with high selectivity C2CD5, DRD4, KCND2 CYP19A1 4698/4885KCNA5 112/4885KIF11 2637/4885

“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.