Hydrochloric Acid

Hydrochloric Acid

SCHEMBL193049

Cl.O=P(O)(O)Cc1ccccc1-[n+]1ccc(-c2ccncc2)cc1.[Cl-]

nearest known ligand 0.42

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
▸ ROCK2 known ✓ O75116 1/20 0.33
▸ PRKCG known ✓ P05129 1/20 0.33
▸ PRKCD known ✓ Q05655 1/20 0.33
▸ ROCK1 known ✓ Q13464 1/20 0.33
▸ GRIN2D known ✓ O15399 1/20 0.32
▸ GRIN3B known ✓ O60391 1/20 0.32
▸ GRIN1 known ✓ Q05586 1/20 0.32
▸ GRIN2A known ✓ Q12879 1/20 0.32
▸ GRIN2B known ✓ Q13224 1/20 0.32
▸ GRIN2C known ✓ Q14957 1/20 0.32
▸ GRIN3A known ✓ Q8TCU5 1/20 0.32
▸ ACP3 P15309 1/20 0.39
▸ MMP2 P08253 2/20 0.37
▸ MMP9 P14780 2/20 0.37
▸ MMP12 P39900 2/20 0.37
▸ NOTUM Q6P988 1/20 0.34
▸ FDPS P14324 1/20 0.34
▸ RPS6KA5 O75582 1/20 0.33
▸ MAP4K4 O95819 1/20 0.33
▸ PRKACA P17612 1/20 0.33

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 SCHEMBL604049 0.84 ACP3 (0.40) ACP3MMP2MMP9MMP12MAPK1
Hydrochloric Acid SCHEMBL600629 0.82 ACP3 (0.38) ACP3MMP2MMP9MMP12MAPK1
Hydrochloric Acid SCHEMBL6448503 0.82 NOTUM (0.31) NOTUMFDPSROCK2RPS6KA5MAP4K4
Hydrochloric Acid SCHEMBL602954 0.80 ACP3 (0.36) ACP3MMP2MMP9MMP12GRIN2D
Hydrochloric Acid SCHEMBL604524 0.80 ALDH1A1 (0.47) ACP3MAPK1MEN1ALDH1A1MAPT
Hydrochloric Acid SCHEMBL603493 0.80 ACP3 (0.39) ACP3MMP2MMP9MMP12MAPK1
Hydrochloric Acid SCHEMBL193315 0.80 ACP3 (0.36) ACP3MMP2MMP9MMP12ALDH1A1
Hydrochloric Acid SCHEMBL193413 0.79 MMP2 (0.37) ACP3MMP2MMP9MMP12MAPK1
Hydrochloric Acid SCHEMBL604501 0.78 PGK1 (0.38) ACP3MMP2MMP9MMP12MAPK1
Hydrochloric Acid SCHEMBL603487 0.77 ANPEP (0.36) ACP3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2401650-A1 ADVANCED ELECTRODE STRUCTURES AND ELECTROCHROMIC DEVICES Ntera, Inc. (US) 2012-01-04 — — EP claimed
WO-2010099147-A1 ADVANCED ELECTRODE STRUCTURES AND ELECTROCHROMIC DEVICES NTERA INC. (US) 2010-09-02 — — WO claimed
EP-2401650-A1 ADVANCED ELECTRODE STRUCTURES AND ELECTROCHROMIC DEVICES Ntera, Inc. (US) 2012-01-04 — — EP disclosed
WO-2010099147-A1 ADVANCED ELECTRODE STRUCTURES AND ELECTROCHROMIC DEVICES NTERA INC. (US) 2010-09-02 — — WO disclosed
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