Hydrochloric Acid

Hydrochloric Acid

SCHEMBL8632698

CCCCCCC=CCCCCCCCC(N)=O.Cl

nearest known ligand 0.96

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
PPARG known ✓ P37231 3/20 0.68
CHRM1 known ✓ P11229 1/20 0.68
TOP1 known ✓ P11387 1/20 0.68
CYP19A1 known ✓ P11511 1/20 0.68
PTGS1 known ✓ P23219 1/20 0.68
SLC6A2 known ✓ P23975 1/20 0.68
FLT3 known ✓ P36888 1/20 0.68
KCNH2 known ✓ Q12809 1/20 0.68
FAAH O00519 4/20 0.96
SOAT1 P35610 2/20 0.96
CYP1A2 P05177 2/20 0.96
CYP2C19 P33261 2/20 0.96
KMT2A Q03164 2/20 0.96
MEN1 O00255 1/20 0.96
TP53 P04637 1/20 0.96
CYP3A4 P08684 1/20 0.96
KDM4E B2RXH2 2/20 0.85
CNR1 P21554 1/20 0.75
TERT O14746 3/20 0.68
PTPN1 P18031 3/20 0.68

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
Oleamide SCHEMBL29585 1.00 FAAH (0.96) FAAHSOAT1CYP1A2CYP2C19KMT2A
Oleamide SCHEMBL15212540 1.00 FAAH (0.96) FAAHSOAT1CYP1A2CYP2C19KMT2A
Hydrochloric Acid SCHEMBL7251090 1.00 FAAH (0.96) FAAHSOAT1CYP1A2CYP2C19KMT2A
Oleamide SCHEMBL3188670 1.00 FAAH (0.96) FAAHSOAT1CYP1A2CYP2C19KMT2A
Oleamide SCHEMBL27974384 0.98 FAAH (0.92) FAAHSOAT1CYP1A2CYP2C19KMT2A
Oleamide SCHEMBL28146913 0.98 FAAH (0.92) FAAHSOAT1CYP1A2CYP2C19KMT2A
Oleamide SCHEMBL27961302 0.98 FAAH (0.92) FAAHSOAT1CYP1A2CYP2C19KMT2A
Oleamide SCHEMBL29123821 0.98 FAAH (0.92) FAAHSOAT1CYP1A2CYP2C19KMT2A
Oleamide SCHEMBL20568155 0.98 FAAH (0.92) FAAHSOAT1CYP1A2CYP2C19KMT2A
Oleamide SCHEMBL28228680 0.98 FAAH (0.92) FAAHSOAT1CYP1A2CYP2C19KMT2A

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
JP-2513877-B2 1996-07-03 JP claimed
EP-0462964-A4 TREATMENT OF SKIN DISEASES AND TUMORS 1993-02-10 EP claimed
EP-0462964-A1 TREATMENT OF SKIN DISEASES AND TUMORS CELLEGY PHARMACEUTICALS, INC. (US) 1992-01-02 EP claimed
WO-1990010441-A1 TREATMENT OF SKIN DISEASES AND TUMORS THORNFELDT CARL R (US) 1990-09-20 WO claimed
US-4868219-A Treatment of skin diseases with aliphatic amines CELLEGY PHARMACEUTICALS, INC. 1989-09-19 US claimed
EP-0462964-B1 Topical compositions containing aliphatic amines for the treatment of skin diseases CELLEGY PHARMA INC (US) 1998-07-22 EP disclosed
EP-0462964-A4 TREATMENT OF SKIN DISEASES AND TUMORS 1993-02-10 EP disclosed
EP-0462964-A1 TREATMENT OF SKIN DISEASES AND TUMORS CELLEGY PHARMACEUTICALS, INC. (US) 1992-01-02 EP disclosed
WO-1990010441-A1 TREATMENT OF SKIN DISEASES AND TUMORS THORNFELDT CARL R (US) 1990-09-20 WO disclosed