Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6891722

CC(C)C1=Cc2c(ccc3ccccc23)C1[Hf+2]1(C2C(C(C)C)=Cc3c2ccc2ccccc32)CC1.[Cl-].[Cl-]

nearest known ligand 0.36

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
KDM4E B2RXH2 2/20 0.36
ADRA2A P08913 2/20 0.32
ADRA2B P18089 2/20 0.32
ADRA2C P18825 2/20 0.32
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
KDM1A O60341 1/20 0.30
POLB P06746 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 SCHEMBL6890325 0.95 KDM4E (0.34) KDM4EADRA2AADRA2BADRA2C
Hydrochloric Acid SCHEMBL6892743 0.87 MAPT (0.34) KDM4EALDH1A1MAPTHPGDKDM1A
Hydrochloric Acid SCHEMBL6895024 0.82 MAPT (0.33) KDM4EALDH1A1MAPTHPGD
Hydrochloric Acid SCHEMBL6892348 0.82 KDM4E (0.33) KDM4E
Hydrochloric Acid SCHEMBL6892280 0.81 HTR1A (0.34)
Hydrochloric Acid SCHEMBL6890394 0.81 KDM4E (0.38) KDM4EALDH1A1MAPTPKMHPGD
Hydrochloric Acid SCHEMBL6886219 0.80 KDM4E (0.36) KDM4EADRA2AADRA2BADRA2CALDH1A1
Hydrochloric Acid SCHEMBL6885456 0.78 KDM4E (0.36) KDM4EALDH1A1MAPTPKMHPGD
Hydrochloric Acid SCHEMBL6889779 0.78 KDM4E (0.41) KDM4EALDH1A1MAPTPKMHPGD
Hydrochloric Acid SCHEMBL6894780 0.77 HTR1A (0.33)

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 KDM4E 2918/4885ADRA2A 2788/4885ADRA2B 3193/4885

“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.