Hydrochloric Acid

Hydrochloric Acid

SCHEMBL937256

Cc1cc2c(s1)Nc1ccccc1N=C2N.Cl

nearest known ligand 0.57

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
DRD2 known ✓ P14416 5/20 0.57
CHRM2 known ✓ P08172 4/20 0.57
CHRM4 known ✓ P08173 4/20 0.57
CHRM5 known ✓ P08912 4/20 0.57
CHRM1 known ✓ P11229 4/20 0.57
CHRM3 known ✓ P20309 4/20 0.57
DRD1 known ✓ P21728 4/20 0.57
ADRA1D known ✓ P25100 4/20 0.57
HTR2A known ✓ P28223 4/20 0.57
HTR2C known ✓ P28335 4/20 0.57
ADRA1A known ✓ P35348 4/20 0.57
HRH1 known ✓ P35367 4/20 0.57
ADRA1B known ✓ P35368 4/20 0.57
HTR2B known ✓ P41595 4/20 0.57
ADRA2A known ✓ P08913 3/20 0.57
ADRA2B known ✓ P18089 3/20 0.57
ADRA2C known ✓ P18825 3/20 0.57
KCNH2 known ✓ Q12809 3/20 0.57
GAA known ✓ P10253 3/20 0.57
DRD4 known ✓ P21917 2/20 0.57

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 SCHEMBL30040103 1.00 DRD2 (0.57) DRD2CHRM2CHRM4CHRM5CHRM1
SCHEMBL79367 0.99 DRD2 (0.58) DRD2CHRM2CHRM4CHRM5CHRM1
SCHEMBL12208493 0.84 DRD2 (0.61) DRD2CHRM2CHRM4CHRM5CHRM1
Hydrochloric Acid SCHEMBL4847359 0.82 DRD2 (0.40) DRD2CHRM2CHRM4CHRM5CHRM1
Hydrochloric Acid SCHEMBL4841102 0.82 CHRM1 (0.40) DRD2CHRM2CHRM4CHRM5CHRM1
Hydrochloric Acid SCHEMBL4846674 0.82 DRD2 (0.40) DRD2CHRM2CHRM4CHRM5CHRM1
Hydrochloric Acid SCHEMBL4840025 0.82 DRD1 (0.40) DRD2CHRM2CHRM4CHRM5CHRM1
Hydrochloric Acid SCHEMBL4844507 0.82 HTR2A (0.40) DRD2CHRM2CHRM4CHRM5CHRM1
Hydrochloric Acid SCHEMBL4839524 0.82 CHRM2 (0.40) DRD2CHRM2CHRM4CHRM5CHRM1
Hydrochloric Acid SCHEMBL15485334 0.81 DRD2 (0.42) DRD2CHRM2CHRM4CHRM5CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014157860-A1 PROCESS FOR THE PREPARATION OF HIGH PURITY OLANZAPINE AND CRYSTALLINE FORM II THEREOF DONG-A ST CO., LTD (KR) 2014-10-02 WO claimed
CN-102276592-B Related substance of olanzapine and preparation method and analytical method thereof UNIV DALIAN TECH 2013-10-16 CN claimed
CN-102268010-A Preparation method and refining method of olanzapine 2011-12-07 CN claimed
EP-1963335-B1 PROCESS FOR THE PREPARATION OF OLANZAPINE EGIS GYOGYSZERGYAR NYILVANOSAN MUKOEDOE RESZVENYTARSASAG (HU) 2011-05-04 EP claimed
EP-1513846-B1 PROCESS OF PREPARATION OF OLANZAPINE FORM I SANDOZ AG (CH) 2011-03-02 EP claimed
US-7834176-B2 Polymorph E of Olanzapine and preparation of anhydrous non-solvated crystalline polymorphic Form I of 2-methyl-4(4-methyl-1-piperazinyl)-10H-thieno[2,3-b][1,5] benzodiazepine (Olanzapine Form I) from the polymorphic Olanzapine Form E SANDOZ AG (CH) 2010-11-16 US claimed
US-7538213-B2 Methods for preparation of olanzapine polymorphic form I INSTITUT FARMACEUTYCZNY (PL) 2009-05-26 US claimed
US-20080161557-A1 Synthesis of 2-Methyl-4-(4-Methyl-1-Piperazinly)-10H-Thieno(2,3-B) (1,5) Benzodiazepine and Salts Thereof LEK PHARMACEUTICALS D.D. (SL) 2008-07-03 US claimed
EP-1611139-B1 METHODS OF PREPARING OLANZAPINE TEVA PHARMA (IL) 2008-06-04 EP claimed
US-RE40033-E1 Process for preparing 2-methyl-thieno-benzodiazepine ELI LILLY AND COMPANY (US) 2008-01-22 US claimed
US-20070072845-A1 Process for the preparation of olanzapine form 1 useful as antipsychotic drug RAMMOHAN RAO DAVULURI 2007-03-29 US claimed
EP-1749010-A2 SYNTHESIS OF 2-METHYL-4-(4-METHYL-1-PIPERAZINYL)-10H-THIENO 2, 3-B 1,5 BENZODIAZEPINE AND SALTS THEREOF LEK Pharmaceuticals D.D. (SI) 2007-02-07 EP claimed
US-20050239772-A1 METHODS FOR PREPARATION OF OLANZAPINE POLYMORPHIC FORM I INSTITUT FARMACEUTYCZNY (PL) 2005-10-27 US claimed
WO-2005090359-A2 SYNTHESIS OF 2-METHYL-4-(4-METHYL-1-PIPERAZINYL)-10H-THIENO[2, 3-B][1,5]BENZODIAZEPINE AND SALTS THEREOF LEK PHARMACEUTICALS D.D. (SI) 2005-09-29 WO claimed
EP-1513846-A1 PROCESS OF PREPARATION OF OLANZAPINE FORM I Sandoz Inc. (US) 2005-03-16 EP claimed
US-20040067936-A1 Process for preparation of hydrates of olanzapine and their conversion into crystalline forms of olanzapine REDDY'S LABORATORIES LIMITED (IN) 2004-04-08 US claimed
US-20040048854-A1 Process of preparation of olanzapine Form I SANDOZ AG (CH) 2004-03-11 US claimed
WO-2003101997-A1 PROCESS OF PREPARATION OF OLANZAPINE FORM I GENEVA PHARMACEUTICALS, INC. (US) 2003-12-11 WO claimed
EP-1313742-A1 PROCESS FOR PREPARATION OF HYDRATES OF OLANZAPINE AND THEIR CONVERSION INTO CRYSTALLINE FORMS OF OLANZAPINE Dr. Reddy's Laboratories Ltd. (IN) 2003-05-28 EP claimed
WO-2002018390-A1 PROCESS FOR PREPARATION OF HYDRATES OF OLANZAPINE AND THEIR CONVERSION INTO CRYSTALLINE FORMS OF OLANZAPINE DR. REDDY'S LABORATORIES LTD. (IN) 2002-03-07 WO claimed

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

For each of this compound's patents that has machine-readable text (4 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-20040048854-A1 Process of preparation of olanzapine Form I HTR1B, CYP1B1, HTR1A DRD2 102/4885CHRM2 220/4885CHRM4 269/4885
US-20080161557-A1 Synthesis of 2-Methyl-4-(4-Methyl-1-Piperazinly)-10H-Thieno(2,3-B) (1,5) Benzodiazepine and Salts Thereof GABRA5, HTR3C, GABRA1 DRD2 17/4885CHRM2 471/4885CHRM4 299/4885
US-20040067936-A1 Process for preparation of hydrates of olanzapine and their conversion into crystalline forms of olanzapine CYP2F1, FIS1, CYP4B1 DRD2 123/4885CHRM2 163/4885CHRM4 207/4885
US-20070072845-A1 Process for the preparation of olanzapine form 1 useful as antipsychotic drug HTR1D, HTR3C, CYP3A5 DRD2 20/4885CHRM2 461/4885CHRM4 322/4885

“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.