Hydrochloric Acid

Hydrochloric Acid

SCHEMBL1142046

CC(C)(N)c1ccc(-c2ccc3[nH]ncc3c2)cc1.Cl.Cl

nearest known ligand 0.59

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
ROCK2 known ✓ O75116 6/20 0.51
JAK2 known ✓ O60674 2/20 0.48
KDR known ✓ P35968 1/20 0.48
ROCK1 known ✓ Q13464 2/20 0.47
GAA known ✓ P10253 1/20 0.47
S1PR1 known ✓ P21453 1/20 0.46
FGFR1 known ✓ P11362 1/20 0.44
GSK3B P49841 6/20 0.59
CLK1 P49759 2/20 0.59
CDK5 Q00535 2/20 0.59
DYRK1A Q13627 2/20 0.59
DYRK3 O43781 1/20 0.59
CLK2 P49760 1/20 0.59
CLK3 P49761 1/20 0.59
CDK5R1 Q15078 1/20 0.59
DYRK2 Q92630 1/20 0.59
CLK4 Q9HAZ1 1/20 0.59
DYRK1B Q9Y463 1/20 0.59
TRPA1 O75762 7/20 0.52
PIM1 P11309 5/20 0.51

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
SCHEMBL1141996 0.98 GSK3B (0.61) GSK3BCLK1CDK5DYRK1ADYRK3
Hydrochloric Acid SCHEMBL1141329 0.88 FGFR1 (0.59) GSK3BCLK1CDK5DYRK1ADYRK3
SCHEMBL1141435 0.86 FGFR1 (0.61) GSK3BCLK1CDK5DYRK1ADYRK3
SCHEMBL29732812 0.86 GSK3B (0.65) GSK3BCLK1CDK5DYRK1ADYRK3
SCHEMBL11911439 0.86 GSK3B (0.65) GSK3BCLK1CDK5DYRK1ADYRK3
Hydrochloric Acid SCHEMBL1141660 0.85 ROCK2 (0.52) GSK3BCLK1CDK5DYRK1ADYRK3
SCHEMBL1141318 0.83 ROCK2 (0.53) GSK3BCLK1CDK5DYRK1ADYRK3
SCHEMBL19922226 0.83 CLK1 (0.68) GSK3BCLK1CDK5DYRK1ADYRK3
Hydrochloric Acid SCHEMBL1142090 0.83 TRPA1 (0.48) GSK3BCLK1CDK5DYRK1ADYRK3
SCHEMBL1142257 0.81 TRPA1 (0.49) GSK3BCLK1CDK5DYRK1ADYRK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250136948-A1 INDUCTION OF PLURIPOTENT CELLS THE SCRIPPS RESEARCH INSTITUTE 2025-05-01 US disclosed
US-12195762-B2 Induction of pluripotent cells THE SCRIPPS RESEARCH INSTITUTE (US) 2025-01-14 US disclosed
EP-4206319-A1 INDUCTION OF PLURIPOTENT CELLS The Scripps Research Institute (US) 2023-07-05 EP disclosed
EP-3235901-B1 INDUCTION OF PLURIPOTENT CELLS SCRIPPS RESEARCH INST (US) 2022-12-21 EP disclosed
US-20210403878-A1 INDUCTION OF PLURIPOTENT CELLS THE SCRIPPS RESEARCH INSTITUTE 2021-12-30 US disclosed
CN-113621576-A Induction of pluripotent cells 斯克里普斯研究所 2021-11-09 CN disclosed
CN-105861446-B Induction of pluripotent cells 斯克里普斯研究所 2021-10-01 CN disclosed
US-11046933-B2 Induction of pluripotent cells THE SCRIPPS RESEARCH INSTITUTE (US) 2021-06-29 US disclosed
US-20180163181-A1 INDUCTION OF PLURIPOTENT CELLS THE SCRIPPS RESEARCH INSTITUTE 2018-06-14 US disclosed
US-9909105-B2 Induction of pluripotent cells THE SCRIPPS RESEARCH INSTITUTE (US) 2018-03-06 US disclosed
CN-1863779-B indazole derivatives UBE INDUSTRIES 2010-05-05 CN disclosed
US-20090264468-A1 Methods for treating a disease in which Rho kinase is involved UBE INDUSTRIES, LTD. (JP) 2009-10-22 US disclosed
US-7563906-B2 Indazole derivatives UBE INDUSTRIES, LTD. (JP) 2009-07-21 US disclosed
US-20090029970-A1 PAIN REMEDY CONTAINING ROCK INHIBITOR ASTELLAS PHARMA INC. (JP) 2009-01-29 US disclosed
US-20090012123-A1 Protective Agent for Retinal Neuronal Cell Comprising Indazole Derivative as Active Ingredient SANTEN PHARMACEUTICAL CO., LTD. (JP) 2009-01-08 US disclosed
EP-1870099-A1 PROTECTIVE AGENT FOR RETINAL NEURONAL CELL COMPRISING INDAZOLE DERIVATIVE AS ACTIVE INGREDIENT Ube Industries, Ltd. (JP) 2007-12-26 EP disclosed
EP-1854484-A1 PAIN REMEDY CONTAINING ROCK INHIBITOR Astellas Pharma Inc. (JP) 2007-11-14 EP disclosed
US-20070129404-A1 Novel indazole derivatives UBE INDUSTRIES, LTD. (JP) 2007-06-07 US disclosed
CN-1863779-A Novel indazole derivative UBE INDUSTRIES (JP) 2006-11-15 CN disclosed
EP-1679308-A1 NOVEL INDAZOLE DERIVATIVE Ube Industries, Ltd. (JP) 2006-07-12 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 (3 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-20090264468-A1 Methods for treating a disease in which Rho kinase is involved RHOA, ROCK1, RHOT2 ROCK2 4/4885JAK2 313/4885KDR 2494/4885
US-20070129404-A1 Novel indazole derivatives CIT, ROCK1, ROCK2 ROCK2 3/4885JAK2 629/4885KDR 957/4885
US-20090012123-A1 Protective Agent for Retinal Neuronal Cell Comprising Indazole Derivative as Active Ingredient GRIK3, ALDH1A2, GRIN3A ROCK2 2678/4885JAK2 4880/4885KDR 3066/4885

“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.