Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6891397

CCC1=Cc2c(-c3cccc4ccccc34)cccc2C1[Zr+2]1(C2C(CC)=Cc3c(-c4cccc5ccccc45)cccc32)CCC1.[Cl-].[Cl-]

nearest known ligand 0.34

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 11)

geneUniProtsupporting neighboursconfidence
SLC6A2 known ✓ P23975 3/20 0.31
SLC6A3 known ✓ Q01959 3/20 0.31
SLC6A4 P31645 7/20 0.34
HTR7 P34969 3/20 0.34
DRD2 P14416 1/20 0.34
HTR1A P08908 2/20 0.32
PPARG P37231 2/20 0.32
PPARA Q07869 2/20 0.32
CYP2D6 P10635 1/20 0.31
KDM4E B2RXH2 1/20 0.30
HRH3 Q9Y5N1 1/20 0.30

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 SCHEMBL4658169 0.95 SLC6A4 (0.35) SLC6A4HTR7DRD2HTR1APPARG
Hydrochloric Acid SCHEMBL6892071 0.91 SLC6A4 (0.35) SLC6A4HTR7DRD2HTR1APPARG
Hydrochloric Acid SCHEMBL6892319 0.89 SLC6A4 (0.34) SLC6A4HTR7DRD2HTR1APPARG
Hydrochloric Acid SCHEMBL6893714 0.88 KDM4E (0.39) SLC6A4HTR7DRD2HTR1ASLC6A2
Hydrochloric Acid SCHEMBL6892134 0.87 HTR1A (0.35) SLC6A4HTR7DRD2HTR1A
Hydrochloric Acid SCHEMBL6886357 0.87 NPC1 (0.32) SLC6A4HTR7DRD2HTR1APPARG
Hydrochloric Acid SCHEMBL4658199 0.86 SLC6A4 (0.36) SLC6A4HTR7DRD2HTR1APPARG
Hydrochloric Acid SCHEMBL6889900 0.85 SLC6A4 (0.33) SLC6A4HTR7DRD2HTR1APPARG
Hydrochloric Acid SCHEMBL6891980 0.84 HTR1A (0.30) HTR7HTR1A
Hydrochloric Acid SCHEMBL6886266 0.84 HTR7 (0.34) SLC6A4HTR7DRD2HTR1ASLC6A2

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 SLC6A2 2028/4885SLC6A3 1338/4885SLC6A4 1973/4885

“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.