Hydrochloric Acid

Hydrochloric Acid

SCHEMBL2897369

Cl.c1ccc(-n2cnnn2)cc1

nearest known ligand 0.95

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 13)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 6/20 0.95
MAPT P10636 2/20 0.61
F2 P00734 1/20 0.61
KCNJ1 P48048 2/20 0.57
KMT2A Q03164 3/20 0.56
RAB9A P51151 1/20 0.56
ALDH1A1 P00352 3/20 0.55
LMNA P02545 2/20 0.55
HTT P42858 1/20 0.55
SMN1; SMN2 Q16637 2/20 0.54
NPSR1 Q6W5P4 1/20 0.53
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50

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
SCHEMBL342739 0.98 NOTUM (1.00) NOTUMMAPTF2KCNJ1KMT2A
SCHEMBL3962509 0.95 NOTUM (0.95) NOTUMMAPTF2KCNJ1KMT2A
SCHEMBL7096356 0.95 NOTUM (0.95) NOTUMMAPTF2KCNJ1KMT2A
Bromide SCHEMBL3939883 0.95 NOTUM (0.95) NOTUMMAPTF2KCNJ1KMT2A
SCHEMBL28994295 0.95 NOTUM (0.95) NOTUMMAPTF2KCNJ1KMT2A
SCHEMBL987888 0.90 NOTUM (0.84) NOTUMMAPTF2KCNJ1KMT2A
Aniline SCHEMBL28041584 0.88 NOTUM (0.81) NOTUMMAPTF2KCNJ1KMT2A
SCHEMBL20720498 0.86 NOTUM (0.78) NOTUMMAPTF2KCNJ1KMT2A
Dimethyl Sulfone SCHEMBL20720495 0.86 NOTUM (0.78) NOTUMMAPTF2KCNJ1KMT2A
Thiophene SCHEMBL5329358 0.86 NOTUM (0.78) NOTUMMAPTF2KCNJ1KMT2A

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9618503-B2 Method for determining the production of reactive oxygen species in a cellular population UNIVERSIDAD AUTONOMA DE BARCELONA (ES) 2017-04-11 US disclosed
CN-106459208-A Dual targeting of TAFI and PAI-1 鲁汶天主教大学 2017-02-22 CN disclosed
US-9233969-B2 Therapeutic agent for cerebral infarction MITSUBISHI TANABE PHARMA CORPORATION (JP) 2016-01-12 US disclosed
US-20150105400-A1 THERAPEUTIC AGENT FOR CEREBRAL INFARCTION MITSUBISHI TANABE PHARMA CORPORATION (JP) 2015-04-16 US disclosed
US-20150104483-A1 THERAPEUTIC AGENT FOR CEREBRAL INFARCTION MITSUBISHI TANABE PHARMA CORPORATION (JP) 2015-04-16 US disclosed
US-20140350249-A1 THERAPEUTIC AGENT FOR CEREBRAL INFARCTION MITSUBISHI TANABE PHARMA CORPORATION (JP) 2014-11-27 US disclosed
US-20140350250-A1 THERAPEUTIC AGENT FOR CEREBRAL INFARCTION MITSUBISHI TANABE PHARMA CORPORATION (JP) 2014-11-27 US disclosed
US-8835631-B2 Therapeutic agent for cerebral infarction MITSUBISHI TANABE PHARMA CORPORATION (JP) 2014-09-16 US disclosed
US-8735623-B2 Process for preparing creatine amides VERTEX CLOSED JOINT STOCK COMPANY (RU) 2014-05-27 US disclosed
US-20130224737-A1 Method For Determining The Production Of Reactive Oxygen Species In A Cellular Population UNIVERSIDAD AUTONOMA DE BARCELONA (ES) 2013-08-29 US disclosed
EP-2532658-A1 Therapeutic agent for cerebral infarction Mitsubishi Tanabe Pharma Corporation (JP) 2012-12-12 EP disclosed
US-20120277459-A1 PROCESS FOR PREPARING CREATINE AMIDES VERTEX CLOSED JOINT STOCK COMPANY (RU) 2012-11-01 US disclosed
US-20100179157-A1 THERAPEUTIC AGENT FOR CEREBRAL INFARCTION MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-07-15 US disclosed
EP-2154135-A1 THERAPEUTIC AGENT FOR CEREBRAL INFARCTION Mitsubishi Tanabe Pharma Corporation (JP) 2010-02-17 EP disclosed
US-6617126-B1 Adding sterile-filtered yeast extract or p-iodonitrotetrazolium violet to the culture medium BIOTEST AG (DE) 2003-09-09 US disclosed
US-6168930-B1 RELIABLE, LOW COST METHOD FOR CULTURING AND DETECTING BACTERIA AND FUNGI BY ADDING YEAST EXTRACT WHICH HAS BEEN STERILE FILTERED AND P-IODONITROTETRAZOLIUM VIOLET TO MEDIUM; FOR SYNERGISTICALLY INCREASED COLOR INTENSITY BIOTEST AG (DE) 2001-01-02 US disclosed
EP-0438502-A1 TECHNETIUM IMAGING AGENTS. CENTOCOR INC (US) 1991-07-31 EP disclosed
WO-1990003802-A2 TECHNETIUM IMAGING AGENTS CENTOCOR, INC. (US) 1990-04-19 WO disclosed
EP-0128521-A2 Composition and method for the detection of bacteria EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1984-12-19 EP disclosed
EP-0091810-A2 Aldehyde oxidase, process for its production and microorganism therefor KYOWA HAKKO KOGYO CO., LTD. (JP) 1983-10-19 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150105400-A1 THERAPEUTIC AGENT FOR CEREBRAL INFARCTION CCL2, IL1B, IL1A NOTUM 2701/4885MAPT 2017/4885F2 3012/4885
US-20100179157-A1 THERAPEUTIC AGENT FOR CEREBRAL INFARCTION CCL2, IL1A, IL6 NOTUM 2863/4885MAPT 2136/4885F2 2850/4885
US-20140350249-A1 THERAPEUTIC AGENT FOR CEREBRAL INFARCTION CCL2, IL1A, IL6 NOTUM 2863/4885MAPT 2136/4885F2 2850/4885
US-20140350250-A1 THERAPEUTIC AGENT FOR CEREBRAL INFARCTION CCL2, IL1A, IL6 NOTUM 2863/4885MAPT 2136/4885F2 2850/4885
US-20150104483-A1 THERAPEUTIC AGENT FOR CEREBRAL INFARCTION CCL2, IL1A, IL6 NOTUM 2863/4885MAPT 2136/4885F2 2850/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.