Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5169138

CCc1ccc(CCOc2ccc(C=C3SC(=O)NC3=O)cc2)nc1.Cl

nearest known ligand 0.72

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 9)

geneUniProtsupporting neighboursconfidence
PPARG known ✓ P37231 2/20 0.60
HPGD P15428 13/20 0.72
CISD1 Q9NZ45 1/20 0.70
PIM1 P11309 3/20 0.62
PIM2 Q9P1W9 3/20 0.62
CYP3A4 P08684 1/20 0.60
RXRA P19793 1/20 0.60
IGF1R P08069 1/20 0.58
PTPN1 P18031 2/20 0.55

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
SCHEMBL29668090 0.99 HPGD (0.74) HPGDCISD1PIM1PIM2PPARG
SCHEMBL2002770 0.99 HPGD (0.74) HPGDCISD1PIM1PIM2PPARG
SCHEMBL1162295 0.99 HPGD (0.74) HPGDCISD1PIM1PIM2PPARG
SCHEMBL2002766 0.99 HPGD (0.74) HPGDCISD1PIM1PIM2PPARG
Hydrochloric Acid SCHEMBL5169128 0.97 HPGD (0.71) HPGDCISD1PIM1PIM2PPARG
SCHEMBL4743937 0.91 HPGD (0.64) HPGDCISD1PIM1PIM2PPARG
SCHEMBL4743932 0.91 HPGD (0.64) HPGDCISD1PIM1PIM2PPARG
Hydrochloric Acid SCHEMBL5169131 0.88 PPARG (0.59) HPGDCISD1PIM1PIM2PPARG
SCHEMBL2002768 0.87 HPGD (0.59) HPGDCISD1PIM1PIM2PPARG
SCHEMBL20302565 0.85 HPGD (0.59) HPGDCISD1PIM1PIM2PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1694646-B1 PROCESS FOR THE SYNTHESIS OF PIOGLITAZONE HYDROGEN CHLORIDE RICHTER GEDEON VEGYESZET (HU) 2007-04-25 EP claimed
EP-1694646-A1 PROCESS FOR THE SYNTHESIS OF PIOGLITAZONE HYDROGEN CHLORIDE RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 2006-08-30 EP claimed
WO-2005058827-A1 PROCESS FOR THE SYNTHESIS OF PIOGLITAZONE HYDROGEN CHLORIDE Richter Gedeon Vegyészeti Gyár Rt. (HU) 2005-06-30 WO claimed
EP-1694646-B1 PROCESS FOR THE SYNTHESIS OF PIOGLITAZONE HYDROGEN CHLORIDE RICHTER GEDEON VEGYESZET (HU) 2007-04-25 EP disclosed
EP-1694646-B1 PROCESS FOR THE SYNTHESIS OF PIOGLITAZONE HYDROGEN CHLORIDE RICHTER GEDEON VEGYESZET (HU) 2007-04-25 EP disclosed
EP-1694646-A1 PROCESS FOR THE SYNTHESIS OF PIOGLITAZONE HYDROGEN CHLORIDE RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 2006-08-30 EP disclosed
EP-1694646-A1 PROCESS FOR THE SYNTHESIS OF PIOGLITAZONE HYDROGEN CHLORIDE RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 2006-08-30 EP disclosed
WO-2005058827-A1 PROCESS FOR THE SYNTHESIS OF PIOGLITAZONE HYDROGEN CHLORIDE Richter Gedeon Vegyészeti Gyár Rt. (HU) 2005-06-30 WO disclosed
WO-2005058827-A1 PROCESS FOR THE SYNTHESIS OF PIOGLITAZONE HYDROGEN CHLORIDE Richter Gedeon Vegyészeti Gyár Rt. (HU) 2005-06-30 WO disclosed