Hydrochloric Acid

Hydrochloric Acid

SCHEMBL25371925

CCCCCCCCc1ccc(C(N)(CO)CO)cc1.Cl

nearest known ligand 0.67

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 20)

geneUniProtsupporting neighboursconfidence
S1PR1 known ✓ P21453 8/20 0.67
S1PR4 known ✓ O95977 7/20 0.64
S1PR3 known ✓ Q99500 6/20 0.64
S1PR5 known ✓ Q9H228 5/20 0.64
ESR1 known ✓ P03372 2/20 0.53
ADRA2A known ✓ P08913 2/20 0.53
SLC6A2 known ✓ P23975 2/20 0.53
SLC6A4 known ✓ P31645 2/20 0.53
SLC6A3 known ✓ Q01959 2/20 0.53
ADRB3 known ✓ P13945 1/20 0.53
HTR2C known ✓ P28335 1/20 0.53
EGFR known ✓ P00533 1/20 0.53
LCK known ✓ P06239 1/20 0.53
CHRM2 known ✓ P08172 1/20 0.53
CHRM5 known ✓ P08912 1/20 0.53
CHRM1 known ✓ P11229 1/20 0.53
ADRA2B known ✓ P18089 1/20 0.53
ADRA2C known ✓ P18825 1/20 0.53
CHRM3 known ✓ P20309 1/20 0.53
ACHE known ✓ P22303 1/20 0.53

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
SCHEMBL8498597 0.98 S1PR1 (0.66) S1PR1S1PR4S1PR3TNNC1S1PR5
SCHEMBL8498533 0.98 S1PR1 (0.66) S1PR1S1PR4S1PR3TNNC1S1PR5
SCHEMBL26881637 0.98 S1PR1 (0.66) S1PR1S1PR4S1PR3TNNC1S1PR5
SCHEMBL8495721 0.98 S1PR1 (0.66) S1PR1S1PR4S1PR3TNNC1S1PR5
SCHEMBL8500217 0.98 S1PR1 (0.66) S1PR1S1PR4S1PR3TNNC1S1PR5
SCHEMBL25703818 0.84 HTR2A (0.58) S1PR1S1PR4S1PR3TNNC1S1PR5
SCHEMBL13165347 0.83 S1PR1 (0.54) S1PR1S1PR4S1PR3TNNC1S1PR5
Hydrochloric Acid SCHEMBL25371922 0.81 S1PR1 (0.52) S1PR1S1PR4S1PR3TNNC1S1PR5
Hydrochloric Acid SCHEMBL8498778 0.80 S1PR1 (1.00) S1PR1S1PR4S1PR3TNNC1S1PR5
Hydrochloric Acid SCHEMBL8499671 0.80 S1PR1 (0.88) S1PR1S1PR4S1PR3TNNC1S1PR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230270696-A1 MEDICINAL USE OF FINGOLIMOD IN PREVENTION AND TREATMENT OF NEURODEGENERATIVE DISEASES CAUSED BY SPHINGOLIPID DISORDERS CHEN DAN (CN) 2023-08-31 US claimed
WO-2022095610-A1 MEDICINAL USE OF FINGOLIMOD IN PREVENTING AND TREATING NEURODEGENERATIVE DISEASES CAUSED BY SPHINGOLIPID DISORDERS 杭州端丽生物技术有限公司 2022-05-12 WO claimed
CN-119424398-A Application of fingolimod in preparation of medicine for treating hepatolenticular degeneration 上海交通大学医学院附属新华医院 2025-02-14 CN disclosed
CN-117379407-A Application of fingolimod in preparation of medicine for treating acute myelogenous leukemia 北京大学人民医院 2024-01-12 CN disclosed
US-20230270696-A1 MEDICINAL USE OF FINGOLIMOD IN PREVENTION AND TREATMENT OF NEURODEGENERATIVE DISEASES CAUSED BY SPHINGOLIPID DISORDERS CHEN DAN (CN) 2023-08-31 US disclosed
CN-114796180-A Use of myriocin and fingolimod in inhibiting candida auriculata 复旦大学 2022-07-29 CN disclosed
WO-2022095610-A1 MEDICINAL USE OF FINGOLIMOD IN PREVENTING AND TREATING NEURODEGENERATIVE DISEASES CAUSED BY SPHINGOLIPID DISORDERS 杭州端丽生物技术有限公司 2022-05-12 WO disclosed
CN-112237575-A Medical application of fingolimod in preventing and treating neurodegenerative diseases caused by sphingolipid disorder 杭州端丽生物技术有限公司 2021-01-19 CN disclosed
CN-111455019-A Application of compound FTY720 in preparation of detection marker for treating behavioral and movement abnormalities 杭州端丽生物技术有限公司 2020-07-28 CN disclosed
CN-108642129-A Medical application of impulse control disorder biological detection marker and Impulse sin 杭州端丽生物技术有限公司 2018-10-12 CN disclosed