Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7205702

CCOc1ccc(C2CN(C)CCC2N)cc1OC.Cl.Cl

nearest known ligand 0.49

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
DPP4 known ✓ P27487 7/20 0.49
GAA known ✓ P10253 2/20 0.45
CACNA1F known ✓ O60840 1/20 0.40
CACNA1D known ✓ Q01668 1/20 0.40
CACNA1S known ✓ Q13698 1/20 0.40
CACNA1C known ✓ Q13936 1/20 0.40
KDM1A O60341 2/20 0.45
KDM4E B2RXH2 3/20 0.45
MAPT P10636 3/20 0.45
ALDH1A1 P00352 4/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
HPGD P15428 1/20 0.42
RECQL P46063 1/20 0.42
TP53 P04637 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
ALOX12 P18054 1/20 0.40
QDPR P09417 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
Hydrochloric Acid SCHEMBL7205700 1.00 DPP4 (0.49) DPP4KDM1AKDM4EMAPTGAA
Hydrochloric Acid SCHEMBL7205705 1.00 DPP4 (0.49) DPP4KDM1AKDM4EMAPTGAA
SCHEMBL7212847 0.99 DPP4 (0.50) DPP4KDM1AKDM4EMAPTGAA
SCHEMBL7212853 0.99 DPP4 (0.50) DPP4KDM1AKDM4EMAPTGAA
SCHEMBL7212851 0.99 DPP4 (0.50) DPP4KDM1AKDM4EMAPTGAA
Hydrochloric Acid SCHEMBL6438950 0.95 DPP4 (0.49) DPP4KDM1AMEN1KMT2AQDPR
Hydrochloric Acid SCHEMBL6438943 0.95 DPP4 (0.49) DPP4KDM1AMEN1KMT2AQDPR
Hydrochloric Acid SCHEMBL6438947 0.95 DPP4 (0.49) DPP4KDM1AMEN1KMT2AQDPR
SCHEMBL6441320 0.94 DPP4 (0.50) DPP4KDM1AALDH1A1HPGDQDPR
SCHEMBL6441317 0.94 DPP4 (0.50) DPP4KDM1AALDH1A1HPGDQDPR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0968211-B1 TETRAZOLE DERIVATIVES ALTANA PHARMA AG (DE) 2003-08-27 EP disclosed
EP-0937074-B1 BENZONAPHTHYRIDINES AS BRONCHIAL THERAPEUTICS ALTANA PHARMA AG (DE) 2003-03-12 EP disclosed
US-6143759-A ANTIINFLAMMATORY AGENTS AND ANTICOAGULANTS BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 2000-11-07 US disclosed
EP-0968211-A1 NOVEL TETRAZOLES Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 2000-01-05 EP disclosed
US-6008215-A TREATING INFLAMMATORY AIRWAY DISORDERS BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1999-12-28 US disclosed
EP-0937074-A1 BENZONAPHTHYRIDINES AS BRONCHIAL THERAPEUTICS Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1999-08-25 EP disclosed
WO-1998040382-A1 NOVEL TETRAZOLES BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1998-09-17 WO disclosed
WO-1998021208-A1 BENZONAPHTHYRIDINES AS BRONCHIAL THERAPEUTICS BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1998-05-22 WO disclosed