Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6330160

CCCOc1ccccc1C(C)(C)C1=C([Ti+2])CC=C1.[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 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 known ✓ P23975 1/20 0.31
SLC6A3 known ✓ Q01959 1/20 0.31
CYP1A2 P05177 2/20 0.36
CYP2C19 P33261 2/20 0.36
CYP2D6 P10635 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ALDH1A1 P00352 6/20 0.35
HTR2B P41595 2/20 0.35
HTR2C P28335 1/20 0.35
KDM4E B2RXH2 4/20 0.34
NPSR1 Q6W5P4 3/20 0.33
HTT P42858 3/20 0.33
TDP1 Q9NUW8 3/20 0.33
MAPT P10636 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 3/20 0.33
HTR1A P08908 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32

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 SCHEMBL6332613 0.94 CYP1A2 (0.39) CYP1A2CYP2C19CYP2D6HSD17B10ALDH1A1
Hydrochloric Acid SCHEMBL6338571 0.91 ALDH1A1 (0.36) CYP1A2CYP2C19CYP2D6HSD17B10ALDH1A1
Hydrochloric Acid SCHEMBL6340581 0.82
Hydrochloric Acid SCHEMBL6332582 0.82 CA1 (0.34) CYP2D6NPSR1TDP1MAPTGAA
Hydrochloric Acid SCHEMBL6332917 0.79
Hydrochloric Acid SCHEMBL6334428 0.79 ADRA2A (0.33) ALDH1A1NISCH
SCHEMBL7204305 0.77 CYP1A2 (0.40) CYP1A2CYP2C19CYP2D6HSD17B10ALDH1A1
Hydrochloric Acid SCHEMBL6333776 0.73 PDE5A (0.40) CYP1A2CYP2C19ALDH1A1HTR2BHTR2C
Hydrochloric Acid SCHEMBL6338996 0.72 PTGS2 (0.36)
Hydrochloric Acid SCHEMBL6338574 0.72 HTR2A (0.36) CYP1A2CYP2C19CYP2D6HSD17B10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6870017-B2 Transition metal compound, catalyst for addition polymerization, and process for producing addition polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-03-22 US disclosed
US-6548686-B2 Coordination catalysts; suppresses heat generation SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-04-15 US disclosed
US-20020013433-A1 Transition metal compound, catalyst for addition polymerization, and process for producing addition polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-01-31 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-20020013433-A1 Transition metal compound, catalyst for addition polymerization, and process for producing addition polymer ASH2L, ARL1, AS3MT SLC6A2 4111/4885SLC6A3 3943/4885CYP1A2 3606/4885

“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.