Hydrochloric Acid

Hydrochloric Acid

SCHEMBL393678

CC(C)c1cccc(C(C)C)c1O[Ti+2]C1c2ccccc2-c2ccccc21.[Cl-].[Cl-]

nearest known ligand 0.42

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 0.32
DPP4 P27487 3/20 0.37
NR1H2 P55055 1/20 0.37
NR1H3 Q13133 1/20 0.37
ANPEP P15144 3/20 0.33
GABRA1 P14867 3/20 0.32
GABRB2 P47870 2/20 0.32
TSHR P16473 2/20 0.32
GABRG2 P18507 2/20 0.32
GABRB3 P28472 2/20 0.32
FAAH O00519 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
LMNA P02545 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
HPGD P15428 1/20 0.32
GABRB1 P18505 1/20 0.32
PTGS1 P23219 1/20 0.32
HTR2C P28335 1/20 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 SCHEMBL715077 0.77 DPP4 (0.37) DPP4NR1H2NR1H3ANPEPGABRA1
Hydrochloric Acid SCHEMBL395193 0.74
Hydrochloric Acid SCHEMBL4232392 0.72 GABRA1 (0.44) DPP4ANPEPGABRA1GABRB2TSHR
SCHEMBL28856362 0.66 GABRA1 (0.41) DPP4NR1H2NR1H3GABRA1GABRB2
SCHEMBL21064361 0.64 GABRA1 (0.45) DPP4NR1H2NR1H3ANPEPGABRA1
SCHEMBL4078392 0.64 GABRA1 (0.39) DPP4NR1H2NR1H3ANPEPGABRA1
SCHEMBL17024335 0.64 DPP4 (0.37) DPP4NR1H2NR1H3ANPEPGABRA1
SCHEMBL10521097 0.63 GABRA1 (0.48) DPP4ANPEPGABRA1GABRB2TSHR
Hydrochloric Acid SCHEMBL395593 0.62 GPR3 (0.42) CYP1A2SLC6A2POLBMEN1KMT2A
SCHEMBL9271255 0.62 GABRA1 (0.52) GABRA1GABRB2TSHRGABRG2GABRB3

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-8431659-B2 Prepolymerized catalyst for olefin polymerization, method of producing this prepolymerized catalyst and method of producing olefin polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-04-30 US disclosed
US-20120095173-A1 PREPOLYMERIZED CATALYST FOR OLEFIN POLYMERIZATION, METHOD OF PRODUCING THIS PREPOLYMERIZED CATALYST AND METHOD OF PRODUCING OLEFIN POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-04-19 US disclosed
US-8101537-B2 Prepolymerized catalyst for olefin polymerization, method of producing this prepolymerized catalyst and method of producing olefin polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-01-24 US disclosed
US-20100280196-A1 PREPOLYMERIZED CATALYST FOR OLEFIN POLYMERIZATION, METHOD OF PRODUCING THIS PREPOLYMERIZED CATALYST AND METHOD OF PRODUCING OLEFIN POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-04 US disclosed