Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7569613

Cl.O.O.O.O.O.[Ru].c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1.c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1.c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1

nearest known ligand 0.49

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
▸ JAK2 known ✓ O60674 1/20 0.49
▸ PRKD3 known ✓ O94806 1/20 0.49
▸ CSF1R known ✓ P07333 1/20 0.49
▸ RET known ✓ P07949 1/20 0.49
▸ FGFR1 known ✓ P11362 1/20 0.49
▸ FLT1 known ✓ P17948 1/20 0.49
▸ KDR known ✓ P35968 1/20 0.49
▸ PRKCQ known ✓ Q04759 1/20 0.49
▸ ACVR1 known ✓ Q04771 1/20 0.49
▸ ROCK1 known ✓ Q13464 1/20 0.49
▸ NTRK3 known ✓ Q16288 1/20 0.49
▸ NTRK2 known ✓ Q16620 1/20 0.49
▸ ALK known ✓ Q9UM73 1/20 0.49
▸ TOP2A known ✓ P11388 2/20 0.48
▸ PIK3CA known ✓ P42336 1/20 0.44
▸ TOP1 known ✓ P11387 1/20 0.40
▸ CCR5 known ✓ P51681 2/20 0.39
▸ LRRK2 Q5S007 2/20 0.49
▸ IKBKB O14920 1/20 0.49
▸ CHUK O15111 1/20 0.49

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 SCHEMBL3153505 1.00 LRRK2 (0.49) LRRK2IKBKBCHUKDAPK3JAK2
Water SCHEMBL3153138 0.98 LRRK2 (0.50) LRRK2IKBKBCHUKDAPK3JAK2
Hydrochloric Acid SCHEMBL1238412 0.98 IKBKB (0.50) LRRK2IKBKBCHUKDAPK3JAK2
Hydrochloric Acid SCHEMBL3793577 0.98 IKBKB (0.50) LRRK2IKBKBCHUKDAPK3JAK2
Hydrochloric Acid SCHEMBL3651626 0.98 IKBKB (0.50) LRRK2IKBKBCHUKDAPK3JAK2
Hydrochloric Acid SCHEMBL4439808 0.98 IKBKB (0.50) LRRK2IKBKBCHUKDAPK3JAK2
Hydrochloric Acid SCHEMBL3328059 0.96 IKBKB (0.52) LRRK2IKBKBCHUKDAPK3JAK2
SCHEMBL4295175 0.96 IKBKB (0.52) LRRK2IKBKBCHUKDAPK3JAK2
Hydrochloric Acid SCHEMBL3328064 0.96 IKBKB (0.52) LRRK2IKBKBCHUKDAPK3JAK2
SCHEMBL173464 0.96 IKBKB (0.52) LRRK2IKBKBCHUKDAPK3JAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0830579-B1 FORMULATIONS AND METHOD OF USE OF PRESSURE SENSITIVE PAINT MC DONNELL DOUGLAS CORP (US) 2002-09-11 — — EP claimed
EP-0830579-A4 FORMULATIONS AND METHOD OF USE OF PRESSURE SENSITIVE PAINT MC DONNELL DOUGLAS CORP (US) 1999-03-24 — — EP claimed
EP-0830579-A1 FORMULATIONS AND METHOD OF USE OF PRESSURE SENSITIVE PAINT McDONNELL DOUGLAS CORPORATION (US) 1998-03-25 — — EP claimed
US-5612492-A Formulations and method of use of pressure sensitive paint MCDONNELL DOUGLAS CORPORATION (US) 1997-03-18 — — US claimed
WO-1996041142-A1 FORMULATIONS AND METHOD OF USE OF PRESSURE SENSITIVE PAINT MCDONNELL DOUGLAS CORPORATION (US) 1996-12-19 — — WO claimed
EP-0830579-B1 FORMULATIONS AND METHOD OF USE OF PRESSURE SENSITIVE PAINT MC DONNELL DOUGLAS CORP (US) 2002-09-11 — — EP disclosed
EP-0830579-A4 FORMULATIONS AND METHOD OF USE OF PRESSURE SENSITIVE PAINT MC DONNELL DOUGLAS CORP (US) 1999-03-24 — — EP disclosed
EP-0830579-A1 FORMULATIONS AND METHOD OF USE OF PRESSURE SENSITIVE PAINT McDONNELL DOUGLAS CORPORATION (US) 1998-03-25 — — EP disclosed
US-5612492-A Formulations and method of use of pressure sensitive paint MCDONNELL DOUGLAS CORPORATION (US) 1997-03-18 — — US disclosed
US-5612492-A Formulations and method of use of pressure sensitive paint MCDONNELL DOUGLAS CORPORATION (US) 1997-03-18 — — US disclosed
WO-1996041142-A1 FORMULATIONS AND METHOD OF USE OF PRESSURE SENSITIVE PAINT MCDONNELL DOUGLAS CORPORATION (US) 1996-12-19 — — WO disclosed
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