Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4873431

COS(=O)(=O)[O-].C[n+]1ccc(Cn2ncc(N)c2N)c2ccccc21.Cl.Cl

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHECHRM1CHRM3

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
HTR1A P08908 1/20 0.34
MAOA P21397 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
ADRA1A P35348 1/20 0.34
SLC6A3 Q01959 1/20 0.34
KCNH2 Q12809 1/20 0.34
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
ALDH1A1 P00352 2/20 0.32
NPBWR1 P48145 4/20 0.31
TERT O14746 1/20 0.31
RAB9A P51151 2/20 0.31
KDM4E B2RXH2 2/20 0.31
POLB P06746 1/20 0.31
RCE1 Q9Y256 1/20 0.30
RAD52 P43351 1/20 0.30
PKM P14618 1/20 0.30
HPGD P15428 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL13989336 0.88 TSHR (0.38) TSHRALDH1A1NPBWR1RAB9AKDM4E
Hydrochloric Acid SCHEMBL4874636 0.80 HTR1A (0.37) HTR1AMAOASLC6A2SLC6A4ADRA1A
Hydrochloric Acid SCHEMBL4874070 0.78 TSHR (0.38) HTR1AMAOASLC6A2SLC6A4ADRA1A
Hydrochloric Acid SCHEMBL4863978 0.76 TSHR (0.42) HTR1AMAOASLC6A2SLC6A4ADRA1A
Hydrochloric Acid SCHEMBL4867530 0.76 TSHR (0.41) HTR1AMAOASLC6A2SLC6A4ADRA1A
Hydrochloric Acid SCHEMBL4872402 0.70 HTR1A (0.33) HTR1AMAOASLC6A2SLC6A4ADRA1A
SCHEMBL6332742 0.68 RAB9A (0.43) LMNAALDH1A1TERTRAB9AKDM4E
SCHEMBL11527611 0.66 RAB9A (0.41) LMNAALDH1A1TERTRAB9AKDM4E
SCHEMBL6002694 0.66 TSHR (0.47) TSHRALDH1A1NPBWR1RAB9APOLB
SCHEMBL6554349 0.65 CHAT (0.49) LMNAALDH1A1TERTRAB9AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070056120-A1 Cationic diaminopyrazoles, a process for producing them and colorants containing these compounds HFC PRESTIGE INTERNATIONAL OPERATIONS SWITZERLAND SÀRL (CH) 2007-03-15 US claimed
US-7462204-B2 Cationic diaminopyrazoles, a process for producing them and colorants containing these compounds WELLA AG (DE) 2008-12-09 US disclosed
US-20070056120-A1 Cationic diaminopyrazoles, a process for producing them and colorants containing these compounds HFC PRESTIGE INTERNATIONAL OPERATIONS SWITZERLAND SÀRL (CH) 2007-03-15 US disclosed
EP-1687280-A1 CATIONIC DIAMINOPYRAZOLES, A METHOD FOR THE PRODUCTION THEREOF AND DYES CONTAINING THESE COMPOUNDS Wella Aktiengesellschaft (DE) 2006-08-09 EP disclosed
WO-2005051918-A1 CATIONIC DIAMINOPYRAZOLES, A METHOD FOR THE PRODUCTION THEREOF AND DYES CONTAINING THESE COMPOUNDS WELLA AKTIENGESELLSCHAFT (DE) 2005-06-09 WO 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-20070056120-A1 Cationic diaminopyrazoles, a process for producing them and colorants containing these compounds KRT18, DSP, TUBA4A HTR1A 3416/4885MAOA 1189/4885SLC6A2 4408/4885

“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.