Hydrochloric Acid

Hydrochloric Acid

SCHEMBL8197602

Cl.NC(=O)c1cccc2nc3ccccc3cc12

nearest known ligand 0.62

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
GAA known ✓ P10253 2/20 0.62
GLA known ✓ P06280 2/20 0.54
PARP1 known ✓ P09874 7/20 0.47
ACHE known ✓ P22303 1/20 0.45
CSF1R known ✓ P07333 1/20 0.41
RET known ✓ P07949 1/20 0.41
FGFR1 known ✓ P11362 1/20 0.41
PDGFRA known ✓ P16234 1/20 0.41
KDR known ✓ P35968 1/20 0.41
FLT3 known ✓ P36888 1/20 0.41
ROCK1 known ✓ Q13464 1/20 0.41
ALDH1A1 P00352 4/20 0.62
KDM4E B2RXH2 3/20 0.62
IKBKB O14920 1/20 0.58
HPGD P15428 2/20 0.54
KMT2A Q03164 2/20 0.54
NPC1 O15118 2/20 0.54
POLB P06746 2/20 0.54
RAB9A P51151 2/20 0.54
LMNA P02545 1/20 0.54

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
SCHEMBL154847 0.98 ALDH1A1 (0.64) ALDH1A1KDM4EGAAIKBKBGLA
Thiourea SCHEMBL27997998 0.94 ALDH1A1 (0.58) ALDH1A1KDM4EGAAIKBKBGLA
Hydrochloric Acid SCHEMBL9083721 0.86 NR4A1 (0.58) ALDH1A1KDM4EGAAIKBKBGLA
SCHEMBL222908 0.84 NR4A1 (0.60) ALDH1A1KDM4EGAAIKBKBGLA
SCHEMBL27356901 0.84 ALDH1A1 (0.55) ALDH1A1KDM4EGAAIKBKBGLA
Hydrochloric Acid SCHEMBL8048420 0.83 ALDH1A1 (0.50) ALDH1A1KDM4EGAAIKBKBGLA
SCHEMBL5352931 0.83 ALDH1A1 (0.53) ALDH1A1KDM4EGAAIKBKBGLA
Acridine SCHEMBL31147690 0.83 NR4A1 (0.58) ALDH1A1KDM4EGAAGLAHPGD
Water SCHEMBL7769203 0.83 NR4A1 (0.58) ALDH1A1KDM4EGAAIKBKBGLA
Acridine SCHEMBL29774329 0.83 NR4A1 (0.58) ALDH1A1KDM4EGAAGLAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0642343-B1 Acridine carboxamides for the treatment of cancer XENOVA LTD (GB) 2000-08-30 EP disclosed
US-5891886-A PREVENTION DRUG RESISTANCE; ADMINISTERING N-(2-(DIMETHYLAMINO)ETHYL)ACRIDINE-4-CARBOXAMIDE XENOVA LIMITED (GB) 1999-04-06 US disclosed
US-5696131-A ADMINISTERING N-(2-(DIMETHYLAMINO)ETHYL)ACRIDINE-4-CARBOXAMIDE WITH OTHER ANTICANCER DRUGS IN A DIVIDED-DOSE SCHEDULE XENOVA LIMITED (GB) 1997-12-09 US disclosed
EP-0642343-A1 TREATMENT OF CANCERS XENOVA LIMITED (GB) 1995-03-15 EP disclosed
WO-1993024096-A2 USE OF N-(2-(DIMETHYLAMINO)ETHYL)ACRIDINE-4-CARBOXAMIDE AND ITS ANALOGUES FOR CANCER TREATMENT XENOVA LIMITED (GB) 1993-12-09 WO disclosed