Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6472415

CCCCCCCCC1=C([Ti+2]2(C3c4ccccc4-c4ccccc43)CC2)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 14)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 1/20 0.34
SLC6A2 known ✓ P23975 1/20 0.32
BCHE P06276 1/20 0.34
CYP2D6 P10635 1/20 0.32
DRD2 P14416 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
SLC6A4 P31645 1/20 0.32
PTPN1 P18031 1/20 0.32
CYSLTR2 Q9NS75 2/20 0.30
CYSLTR1 Q9Y271 2/20 0.30
GPR3 P46089 1/20 0.30
NR1H2 P55055 1/20 0.30
NR1H3 Q13133 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 SCHEMBL6472198 1.00 BCHE (0.34) BCHEACHECYP2D6DRD2SLC6A2
Hydrochloric Acid SCHEMBL713795 0.95 BCHE (0.35) BCHEACHE
Hydrochloric Acid SCHEMBL6470440 0.90 BCHE (0.31) BCHEACHEGPR3
Hydrochloric Acid SCHEMBL6470828 0.86 GPR3 (0.31) GPR3
Hydrochloric Acid SCHEMBL6473194 0.82 CYP2D6 (0.31) CYP2D6DRD2SLC6A2HTR2AHTR2C
Hydrochloric Acid SCHEMBL6471681 0.82 CYP2D6 (0.31) CYP2D6DRD2SLC6A2HTR2AHTR2C
Hydrochloric Acid SCHEMBL714799 0.77
Hydrochloric Acid SCHEMBL714779 0.76 GPR3 (0.33) GPR3
Hydrochloric Acid SCHEMBL1115906 0.75 BCHE (0.35) BCHEACHECYP2D6DRD2SLC6A2
Hydrochloric Acid SCHEMBL1115760 0.75 BCHE (0.35) BCHEACHECYP2D6DRD2SLC6A2

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-6870015-B2 Catalyst component for addition polymerization, process for producing catalyst for addition polymerization and process for producing addition polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-03-22 US disclosed
EP-1300425-A2 Catalyst component for addition polymerization, process for producing said catalyst and process for producing addition polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-04-09 EP disclosed
US-20030060579-A1 Catalyst component for addition polymerization, process for producing catalyst for addition polymerization and process for producing addition polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-03-27 US disclosed