Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6902433

C=[Ti+2](C1c2ccccc2-c2ccccc21)C1c2ccccc2-c2ccccc21.[Cl-].[Cl-]

nearest known ligand 0.44

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
ACHE known ✓ P22303 3/20 0.32
CHRM2 known ✓ P08172 1/20 0.32
CHRM1 known ✓ P11229 1/20 0.32
SLC6A2 known ✓ P23975 1/20 0.32
SLC6A3 known ✓ Q01959 1/20 0.32
CYP19A1 P11511 1/20 0.39
GPR3 P46089 2/20 0.39
HTR2A P28223 2/20 0.39
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
HDAC9 Q9UKV0 1/20 0.34
HDAC5 Q9UQL6 1/20 0.34
NCOR2 Q9Y618 1/20 0.34
POLB P06746 3/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
BCHE P06276 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
SCHEMBL7035032 0.91 GPR3 (0.41) CYP19A1GPR3HTR2AHDAC3HDAC4
Hydrochloric Acid SCHEMBL7109966 0.78 HTR6 (0.31) HTR2ACYP2D6
SCHEMBL7035025 0.73 GPR3 (0.32) GPR3
Hydrochloric Acid SCHEMBL2049914 0.72 GPR3 (0.34) GPR3HTR2AHDAC3HDAC4HDAC7
Hydrochloric Acid SCHEMBL396686 0.70 GPR3 (0.40) CYP19A1GPR3HTR2AHDAC3HDAC4
Hydrochloric Acid SCHEMBL714923 0.70 POLB (0.42) CYP19A1GPR3HTR2AHDAC3HDAC4
Hydrochloric Acid SCHEMBL8604650 0.70 GPR3 (0.40) CYP19A1GPR3HTR2AHDAC3HDAC4
Hydrochloric Acid SCHEMBL3385863 0.67 GPR3 (0.46) CYP19A1GPR3HTR2AHDAC3HDAC4
SCHEMBL40598 0.67 GPR3 (0.46) CYP19A1GPR3HTR2AHDAC3HDAC4
SCHEMBL14870743 0.67 POLB (0.50) CYP19A1GPR3HTR2AHDAC3HDAC4

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
CN-1229395-C Process for producing vinyl compound polymer SUMITOMO CHEMICAL CO (JP) 2005-11-30 CN disclosed
US-6790917-B2 POLYMERIZING A VINYL COMPOUND IN PRESENCE OF A CATALYST OBTAINED BY COMBINING ORGANOTRANSITION METAL COMPOUND, AN ALUMINUM COMPUND OR ALUMOXANE AND A BORON COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-09-14 US disclosed
US-20020198340-A1 Process for producing vinyl compound polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-12-26 US disclosed
CN-1386765-A Process for producing vinyl compound polymer SUMITOMO CHEMICAL CO (JP) 2002-12-25 CN disclosed