Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6893261

FC(F)(F)c1ccc(-c2cccc3c2C=C(C2CCCC2)C3[Hf+2]2(C3C(C4CCCC4)=Cc4c(-c5ccc(C(F)(F)F)cc5)cccc43)CCC2)cc1.[Cl-].[Cl-]

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

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 10)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
PTGS2 P35354 1/20 0.32
PTPN5 P54829 3/20 0.32
CYP11B1 P15538 5/20 0.32
CYP11B2 P19099 5/20 0.32
PTPN2 P17706 1/20 0.31
CACNA1B Q00975 2/20 0.31
GABBR2 O75899 3/20 0.31
GABBR1 Q9UBS5 3/20 0.31

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 SCHEMBL6891965 0.99 PTGS2 (0.34) TMEM97SIGMAR1PTGS2PTPN5CYP11B1
Hydrochloric Acid SCHEMBL6890422 0.97 SIGMAR1 (0.34) TMEM97SIGMAR1PTGS2PTPN5CYP11B1
Hydrochloric Acid SCHEMBL6891827 0.96 PTGS2 (0.34) TMEM97SIGMAR1PTGS2PTPN5CYP11B1
Hydrochloric Acid SCHEMBL6892440 0.89 PTGS2 (0.32) PTGS2
Hydrochloric Acid SCHEMBL6893372 0.88 PTGS2 (0.34) PTGS2
Hydrochloric Acid SCHEMBL6888491 0.87 TMEM97 (0.33) TMEM97SIGMAR1PTGS2PTPN5CYP11B1
Hydrochloric Acid SCHEMBL6889243 0.86 PTGS2 (0.33) PTGS2PTPN5CYP11B2PTPN2
Hydrochloric Acid SCHEMBL6892184 0.86 PTGS2 (0.34) TMEM97SIGMAR1PTGS2PTPN5CYP11B1
Hydrochloric Acid SCHEMBL6891522 0.85 PTGS2 (0.33) PTGS2
Hydrochloric Acid SCHEMBL6891877 0.85 PTGS2 (0.34) PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6784305-B2 DERIVATIVES OF ZIRCONOCENE DICHLORIDE IN WHICH THE TWO SUBSTITUTED INDENYL GROUPS ARE JOINED TO ONE ANOTHER VIA A BRIDGE CAN, OWING TO THEIR CONFORMATIONAL RIGIDITY, BE USED AS CATALYSTS FOR THE STEREOSPECIFIC POLYMERIZATION OF OLEFINS BASELL POLYOLEFINE GMBH (DE) 2004-08-31 US disclosed
US-20030199703-A1 Method for producing alkyl-bridged ligand systems and transition metal compounds EQUISTAR CHEMICALS, LP 2003-10-23 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 (1 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-20030199703-A1 Method for producing alkyl-bridged ligand systems and transition metal compounds ABL1, ICMT, ORAI2 TMEM97 3758/4885SIGMAR1 3601/4885PTGS2 1334/4885

“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.