Hydrochloric Acid

Hydrochloric Acid

SCHEMBL11307337

Cc1cc(N)c2cc(N(C(N)=O)c3ccc4nc(C)cc(N)c4c3)ccc2n1.Cl

nearest known ligand 0.55

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 16)

geneUniProtsupporting neighboursconfidence
MMP1 known ✓ P03956 1/20 0.55
GNG2 P59768 2/20 0.55
GNB1 P62873 2/20 0.55
MEN1 O00255 1/20 0.55
MMP9 P14780 1/20 0.55
ALOX15 P16050 1/20 0.55
BLM P54132 1/20 0.55
KMT2A Q03164 1/20 0.55
NCF1 P14598 1/20 0.47
ALDH1A1 P00352 1/20 0.47
CASP1 P29466 1/20 0.47
CASP7 P55210 1/20 0.47
HSD17B10 Q99714 1/20 0.47
OPRL1 P41146 2/20 0.44
TERT O14746 1/20 0.44
DOT1L Q8TEK3 1/20 0.43

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
SCHEMBL2777690 0.99 GNG2 (0.56) GNG2GNB1MEN1MMP1MMP9
SCHEMBL2779314 0.83 GNG2 (0.49) GNG2GNB1MEN1MMP1MMP9
SCHEMBL2775377 0.82 GNG2 (0.48) GNG2GNB1MEN1MMP1MMP9
SCHEMBL2780312 0.81 GNG2 (0.47) GNG2GNB1MEN1MMP1MMP9
Hydrochloric Acid SCHEMBL31428470 0.76 GNG2 (0.60) GNG2GNB1MEN1MMP1MMP9
SCHEMBL3238508 0.74 GNG2 (0.61) GNG2GNB1MEN1MMP1MMP9
SCHEMBL807331 0.74 GNG2 (0.68) GNG2GNB1MEN1MMP1MMP9
SCHEMBL8359605 0.74 GNG2 (0.83) GNG2GNB1MEN1MMP1MMP9
Aminoquinuride SCHEMBL14690424 0.73 GNG2 (0.92) GNG2GNB1MEN1MMP1MMP9
Hydrochloric Acid SCHEMBL30579056 0.73 NCF1 (0.61) GNG2GNB1MEN1MMP1MMP9

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
US-4269825-A COMPRISING PROTEIN AND CARBOHYDRATE CONTAINING HEXOSES, N-ACETYLATED-HEXOSAMINE AND-NEURAMINIC ACID, AND FUCOSE; FROM BLOOD AND PLACENTA EXTRACTS; IMMUNOLOGY; ANTIGENS BEHRINGWERKE AG (DE) 1981-05-26 US disclosed
US-4254021-A Tissue specific protein and process for preparing same BEHRINGWERKE AKTIENGESELLSCHAFT (DE) 1981-03-03 US disclosed
US-4217339-A FOR DIAGNOSTIC ANTISERA BEHRINGWERKE AKTIENGESELLSCHAFT (DE) 1980-08-12 US disclosed
US-4183849-A Therapeutic insulin preparation and a process for the production of a stable insulin preparation with protracted effect NORDISK INSULINLABORATORIUM (DK) 1980-01-15 US disclosed
EP-0000134-A1 Glycoprotein, its preparation, its use for the manufacture of antiserum and the antiserum BEHRINGWERKE Aktiengesellschaft (DE) 1979-01-10 EP disclosed