Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7153183

CC(C)(/N=N/C(C)(C)C(=N)NCc1ccccc1)C(=N)NCc1ccccc1.Cl

nearest known ligand 0.46

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
CA2 known ✓ P00918 2/20 0.46
GAA known ✓ P10253 3/20 0.43
MMP8 known ✓ P22894 1/20 0.42
GRIN2D known ✓ O15399 2/20 0.41
GRIN3B known ✓ O60391 2/20 0.41
GRIN1 known ✓ Q05586 2/20 0.41
GRIN2A known ✓ Q12879 2/20 0.41
GRIN2B known ✓ Q13224 2/20 0.41
GRIN2C known ✓ Q14957 2/20 0.41
GRIN3A known ✓ Q8TCU5 2/20 0.41
SIGMAR1 known ✓ Q99720 2/20 0.41
RIPK1 Q13546 1/20 0.46
CA12 O43570 2/20 0.46
CA1 P00915 2/20 0.46
CA9 Q16790 2/20 0.46
ALOX12 P18054 4/20 0.44
HPGD P15428 2/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 2/20 0.44
RAB9A P51151 1/20 0.44

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 SCHEMBL1710615 1.00 RIPK1 (0.46) RIPK1CA12CA1CA2CA9
Hydrochloric Acid SCHEMBL236554 1.00 RIPK1 (0.46) RIPK1CA12CA1CA2CA9
Hydrochloric Acid SCHEMBL4198597 1.00 RIPK1 (0.46) RIPK1CA12CA1CA2CA9
SCHEMBL5280589 0.98 RIPK1 (0.47) RIPK1CA12CA1CA2CA9
SCHEMBL5280585 0.98 RIPK1 (0.47) RIPK1CA12CA1CA2CA9
SCHEMBL5353443 0.85 RIPK1 (0.38) RIPK1CA12CA1CA2CA9
Hydrochloric Acid SCHEMBL16372125 0.84 SMN1; SMN2 (0.50) RIPK1CA12CA1CA2CA9
SCHEMBL11335844 0.74 ALDH1A1 (0.44) RIPK1ALOX12HPGDALDH1A1LMNA
SCHEMBL11335840 0.74 ALDH1A1 (0.44) RIPK1ALOX12HPGDALDH1A1LMNA
Hydrochloric Acid SCHEMBL16371740 0.74 ALOX12 (0.54) CA12CA1CA2CA9ALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6534590-B1 Vinyl monomer, carbosiloxane dendrimer, surfactant, and free radical initiator; waterproof coatings; storage stability DOW CORNING TORAY SILICONE CO., LTD. (JP) 2003-03-18 US disclosed
US-6291021-B1 MATERIAL COMPRISING PENDANT CARBOSILOXANE-DENDRIMER FUNCTIONAL VINYL-TYPE POLYMER COMPRISING CARBOSILOXANE DENDRIMER GROUP AND ACRYLIC RESIN WHICH DOES NOT CONTAIN PENDANT CARBOSILOXANE DENDRIMER STRUCTURE DOW CORNING TORAY SILICONE CO., LTD. (JP) 2001-09-18 US disclosed
EP-1006165-A2 Coating material Dow Corning Toray Silicone Company, Ltd. (JP) 2000-06-07 EP disclosed