Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3201535

CC(O[Ti+2])c1ccccc1C1c2ccccc2-c2ccccc21.[Cl-].[Cl-]

nearest known ligand 0.35

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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 19)

geneUniProtsupporting neighboursconfidence
SLC6A2 known ✓ P23975 1/20 0.32
SLC6A3 known ✓ Q01959 1/20 0.32
ACHE known ✓ P22303 1/20 0.31
ADRA2A P08913 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
POLB P06746 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ATM Q13315 1/20 0.34
GPR3 P46089 1/20 0.33
HTR2A P28223 1/20 0.33
SLC6A4 P31645 1/20 0.32
BCHE P06276 1/20 0.31
DPP4 P27487 1/20 0.30
NR1H2 P55055 1/20 0.30
NR1H3 Q13133 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 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
SCHEMBL28856362 0.77 GABRA1 (0.41) POLBMEN1KMT2AATMGPR3
SCHEMBL3201538 0.77 POLB (0.33) ADRA2AADRA2BADRA2CPOLBMEN1
Hydrochloric Acid SCHEMBL3260463 0.74 GPR3 (0.33) POLBMEN1KMT2AATMGPR3
Hydrochloric Acid SCHEMBL3209078 0.74 ADRA2A (0.30) ADRA2AADRA2BADRA2C
Hydrochloric Acid SCHEMBL3192580 0.74 MAPT (0.33) MEN1KMT2A
Hydrochloric Acid SCHEMBL3259811 0.71 MEN1 (0.34) POLBMEN1KMT2AATMGPR3
Hydrochloric Acid SCHEMBL3211462 0.71 SIGMAR1 (0.33) ADRA2AADRA2BADRA2C
SCHEMBL3213756 0.68 MEN1 (0.40) ADRA2BPOLBMEN1KMT2AATM
SCHEMBL3192965 0.68 MEN1 (0.44) POLBMEN1KMT2AATMGPR3
Hydrochloric Acid SCHEMBL3260904 0.67 GPR3 (0.30) GPR3

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-7671226-B2 Transition metal complex, catalyst for olefin polymerization, and process for producing olefin polymer with the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-02 US disclosed
EP-1426379-B1 TRANSITION METAL COMPLEX,CATALYST FOR OLEFIN POLYMERIZATION, AND PROCESS FOR PRODUCING OLEFIN POLYMER WITH THE SAME SUMITOMO CHEMICAL CO (JP) 2009-11-11 EP disclosed
US-7439379-B2 Transition metal complex, catalyst for olefin polymerization, and process for producing olefin polymer with the same SUMITOMO CHEMICAL CO., LTD. (JP) 2008-10-21 US disclosed