Hydrochloric Acid

Hydrochloric Acid

SCHEMBL29617452

Cl.NOCCNC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.62

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 9)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 known ✓ P41143 1/20 0.42
▸ CA2 known ✓ P00918 1/20 0.42
▸ KMT2A Q03164 2/20 0.62
▸ EPHX2 P34913 1/20 0.50
▸ FABP7 O15540 1/20 0.43
▸ FABP5 Q01469 1/20 0.43
▸ CASP3 P42574 1/20 0.42
▸ TLR2 O60603 1/20 0.42
▸ CA1 P00915 1/20 0.42

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
SCHEMBL29617446 0.99 KMT2A (0.63) KMT2AEPHX2FABP7FABP5CASP3
SCHEMBL20464122 0.99 KMT2A (0.63) KMT2AEPHX2FABP7FABP5CASP3
SCHEMBL12650693 0.91 KMT2A (0.58) KMT2AEPHX2FABP7FABP5CASP3
SCHEMBL30353304 0.90 KMT2A (0.70) KMT2AEPHX2FABP7FABP5CASP3
SCHEMBL6475569 0.86 KMT2A (0.62) KMT2AEPHX2FABP7FABP5CASP3
Hydrochloric Acid SCHEMBL29599906 0.86 KMT2A (0.64) KMT2AEPHX2FABP7FABP5OPRD1
Hydrochloric Acid SCHEMBL966018 0.86 KMT2A (0.64) KMT2AEPHX2FABP7FABP5OPRD1
Hydrochloric Acid SCHEMBL5579268 0.86 KMT2A (0.58) KMT2AEPHX2FABP7FABP5OPRD1
SCHEMBL5579212 0.85 KMT2A (0.55) KMT2AEPHX2FABP7FABP5CASP3
SCHEMBL14116288 0.85 KMT2A (0.63) KMT2AEPHX2FABP7FABP5CASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12097241-B2 Methods of treating kidney failure, and/or improving or stablizing renal function using modified relaxin polypeptides BRISTOL-MYERS SQUIBB COMPANY (US) 2024-09-24 — — US disclosed
US-12097242-B2 Treatment of fibrosis, cardiovascular disease and heart failure with modified relaxin polypeptides BRISTOL-MYERS SQUIBB COMPANY (US) 2024-09-24 — — US disclosed
EP-3580232-B1 MODIFIED RELAXIN POLYPEPTIDES COMPRISING A PHARMACOKINETIC ENHANCER AND USES THEREOF BRISTOL MYERS SQUIBB CO (US) 2023-09-20 — — EP disclosed
US-20220331402-A1 MODIFIED RELAXIN POLYPEPTIDES COMPRISING A PHARMACOKINETIC ENHANCER AND USES THEREOF BRISTOL MYERS SQUIBB CO (US) 2022-10-20 — — US disclosed
US-20220211812-A1 MODIFIED RELAXIN POLYPEPTIDES COMPRISING A PHARMACOKINETIC ENHANCER AND USES THEREOF BRISTOL MYERS SQUIBB CO (US) 2022-07-07 — — US disclosed
US-11364281-B2 Modified relaxin polypeptides comprising a pharmacokinetic enhancer and pharmaceutical compositions thereof BRISTOL-MYERS SQUIBB COMPANY (US) 2022-06-21 — — US 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-12097241-B2 Methods of treating kidney failure, and/or improving or stablizing renal function using modified relaxin polypeptides RXFP2, RXFP1, RXFP4 OPRD1 3714/4885CA2 1427/4885KMT2A 3362/4885
US-20220331402-A1 MODIFIED RELAXIN POLYPEPTIDES COMPRISING A PHARMACOKINETIC ENHANCER AND USES THEREOF RXFP2, RXFP1, RXFP4 OPRD1 2284/4885CA2 2342/4885KMT2A 2670/4885
US-11364281-B2 Modified relaxin polypeptides comprising a pharmacokinetic enhancer and pharmaceutical compositions thereof RXFP2, RXFP1, RXFP4 OPRD1 2026/4885CA2 1955/4885KMT2A 2556/4885
US-20220211812-A1 MODIFIED RELAXIN POLYPEPTIDES COMPRISING A PHARMACOKINETIC ENHANCER AND USES THEREOF RXFP2, RXFP1, RXFP4 OPRD1 2284/4885CA2 2342/4885KMT2A 2670/4885
US-12097242-B2 Treatment of fibrosis, cardiovascular disease and heart failure with modified relaxin polypeptides RXFP2, RXFP1, RXFP4 OPRD1 3145/4885CA2 2564/4885KMT2A 1915/4885

“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.

Send feedback