Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6337018

COC(Cc1ccccc1)C1=C([Ti+2])CC=C1.[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 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 known ✓ P23975 2/20 0.33
SLC6A3 known ✓ Q01959 1/20 0.33
TAAR1 Q96RJ0 4/20 0.33
MAOA P21397 4/20 0.33
SIGMAR1 Q99720 2/20 0.33
SLC6A4 P31645 1/20 0.33
CYP2A6 P11509 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
ALDH1A1 P00352 1/20 0.32
LAP3 P28838 1/20 0.31
CYP2D6 P10635 2/20 0.31
SLC18A2 Q05940 1/20 0.31
EPHX1 P07099 1/20 0.31
MAOB P27338 3/20 0.31
NISCH Q9Y2I1 3/20 0.31
ALPL P05186 1/20 0.30
POLB P06746 1/20 0.30
ALPG P10696 1/20 0.30
MEN1 O00255 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 SCHEMBL6332654 0.86 PPARG (0.33) TAAR1MAOASLC6A2SIGMAR1SLC6A4
Hydrochloric Acid SCHEMBL6341228 0.86 SIGMAR1 (0.34) TAAR1MAOASLC6A2SIGMAR1SLC6A4
Hydrochloric Acid SCHEMBL6332139 0.85 MAOA (0.31) TAAR1MAOASLC6A2SIGMAR1SLC6A4
Hydrochloric Acid SCHEMBL6337004 0.85 ABCB1 (0.32) TAAR1MAOASLC6A2SIGMAR1SLC6A4
Hydrochloric Acid SCHEMBL6338934 0.83 SIGMAR1 (0.31) SIGMAR1
Hydrochloric Acid SCHEMBL6334948 0.81 SIGMAR1 (0.33) SIGMAR1ALDH1A1MEN1KMT2APPARG
Hydrochloric Acid SCHEMBL6334480 0.78
Hydrochloric Acid SCHEMBL6337022 0.73 ABCB1 (0.30)
Hydrochloric Acid SCHEMBL6330209 0.72 MEN1 (0.34) SIGMAR1MEN1KMT2ACYP2C19PPARG
Hydrochloric Acid SCHEMBL6334559 0.70 ABCB1 (0.34) SLC6A2SLC6A4SLC6A3CYP2D6MEN1

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 4 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-20030171212-A1 Transition metal compound, catalyst for addition polymerization, and process for producing addition polymer SUMITOMO CHEMICAL COMPANY, LIMITED 2003-09-11 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 3943/4885TAAR1 2398/4885

“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.