Hydrochloric Acid

Hydrochloric Acid

SCHEMBL29633116

Cl.Cl.O=C(Nc1ccncc1)C1CCCCC1

nearest known ligand 0.67

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 4/20 0.63
ROCK1 known ✓ Q13464 4/20 0.63
PRKCE known ✓ Q02156 1/20 0.62
GLA known ✓ P06280 1/20 0.60
PRKD3 known ✓ O94806 1/20 0.60
PRKCQ known ✓ Q04759 1/20 0.60
PRKCD known ✓ Q05655 1/20 0.60
KCNH2 known ✓ Q12809 1/20 0.60
PTPN1 P18031 2/20 0.67
HPGD P15428 2/20 0.67
PKN2 Q16513 3/20 0.62
TP53 P04637 2/20 0.62
CYP3A4 P08684 2/20 0.62
LMNA P02545 2/20 0.62
ALOX15 P16050 1/20 0.62
TSHR P16473 2/20 0.62
MAPK1 P28482 1/20 0.62
RPS6KA5 O75582 2/20 0.60
LRRK2 Q5S007 2/20 0.60
CHUK O15111 1/20 0.60

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
SCHEMBL5578926 0.98 PTPN1 (0.69) PTPN1HPGDROCK2ROCK1PKN2
Hydrochloric Acid SCHEMBL27545321 0.91 ROCK2 (0.73) PTPN1HPGDROCK2ROCK1PKN2
SCHEMBL30828553 0.89 ROCK2 (0.76) PTPN1HPGDROCK2ROCK1PKN2
SCHEMBL7520976 0.89 ROCK2 (0.76) PTPN1HPGDROCK2ROCK1PKN2
SCHEMBL28656982 0.85 PTPN1 (0.89) PTPN1HPGDLMNAPTPN2NAMPT
SCHEMBL125695 0.85 PTPN1 (0.89) PTPN1HPGDLMNAPTPN2NAMPT
SCHEMBL7327230 0.84 EPHX1 (0.56) PTPN1HPGDROCK2ROCK1PKN2
Hydrochloric Acid SCHEMBL27414471 0.83 ROCK2 (0.60) PTPN1ROCK2ROCK1PKN2TP53
SCHEMBL30828597 0.83 ACVRL1 (0.72) PTPN1ROCK2ROCK1PKN2TP53
SCHEMBL2105849 0.83 ROCK2 (0.63) PTPN1HPGDROCK2ROCK1PKN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260000735-A1 ENHANCED DIFFERENTIATION OF BETA CELLS VERTEX PHARMACEUTICALS INCORPORATED (US) 2026-01-01 US disclosed
US-20250236844-A1 STEM CELL DERIVED ISLET DIFFERENTIATION VERTEX PHARMACEUTICALS INCORPORATED (US) 2025-07-24 US disclosed
US-12215355-B2 Stem cell derived islet differentiation VERTEX PHARMACEUTICALS INCORPORATED (US) 2025-02-04 US disclosed
US-20240425817-A1 ENHANCED DIFFERENTIATION OF BETA CELLS VERTEX PHARMACEUTICALS INCORPORATED (US) 2024-12-26 US disclosed
US-11999971-B2 Stem cell derived islet differentiation VERTEX PHARMACEUTICALS INCORPORATED (US) 2024-06-04 US disclosed
US-20240093144-A1 DIFFERENTIAL ADHESION AND TENSION GUIDED FORMATION OF STEM CELL DERIVED EMBRYOS CALIFORNIA INSTITUTE OF TECHNOLOGY 2024-03-21 US disclosed
EP-4271399-A1 ENHANCED DIFFERENTIATION OF BETA CELLS Vertex Pharmaceuticals Incorporated (US) 2023-11-08 EP disclosed
US-20230085395-A1 STEM CELL DERIVED ISLET DIFFERENTIATION VERTEX PHARMACEUTICALS INCORPORATED 2023-03-16 US disclosed
US-20230075375-A1 STEM CELL DERIVED ISLET DIFFERENTIATION VERTEX PHARMACEUTICALS INCORPORATED 2023-03-09 US disclosed
US-11525120-B2 Stem cell derived islet differentiation VERTEX PHARMACEUTICALS INCORPORATED (US) 2022-12-13 US disclosed
US-11466256-B2 Stem cell derived islet differentiation VERTEX PHARMACEUTICALS INCORPORATED (US) 2022-10-11 US disclosed
US-20220233646-A1 ENHANCED DIFFERENTIATION OF BETA CELLS VERTEX PHARMACEUTICALS INCORPORATED 2022-07-28 US disclosed
WO-2022147056-A1 ENHANCED DIFFERENTIATION OF BETA CELLS VERTEX PHARMACEUTICALS INCORPORATED (US) 2022-07-07 WO disclosed
EP-3990624-A1 ENHANCED DIFFERENTIATION OF BETA CELLS Vertex Pharmaceuticals Incorporated (US) 2022-05-04 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-20260000735-A1 ENHANCED DIFFERENTIATION OF BETA CELLS IAPP, PNLIP, PPARD ROCK2 3901/4885ROCK1 3753/4885PRKCE 215/4885
US-20240425817-A1 ENHANCED DIFFERENTIATION OF BETA CELLS IAPP, AMY2A, CEL ROCK2 4590/4885ROCK1 4712/4885PRKCE 1436/4885
US-20220233646-A1 ENHANCED DIFFERENTIATION OF BETA CELLS IAPP, AMY2A, RNASE1 ROCK2 4496/4885ROCK1 4716/4885PRKCE 1660/4885

“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.