Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7526331

CC1C(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)=C(C2=C(c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C([Hf+2])c3ccccc32)c2ccccc21.[Cl-].[Cl-]

nearest known ligand 0.33

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
TACR1 known ✓ P25103 7/20 0.32
HTR1A P08908 1/20 0.32
HTR7 P34969 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
CYP1A2 P05177 1/20 0.31
POLB P06746 1/20 0.31
CYP2C9 P11712 1/20 0.31
HPGD P15428 1/20 0.31
CYP2C19 P33261 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
ATP1A1 P05023 1/20 0.31
ATP1B1 P05026 1/20 0.31
ATP1A3 P13637 1/20 0.31
ATP1B2 P14415 1/20 0.31
ATP1A2 P50993 1/20 0.31
ATP1B3 P54709 1/20 0.31
FXYD2 P54710 1/20 0.31
ATP1A4 Q13733 1/20 0.31

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 SCHEMBL6927007 0.96 TACR1 (0.34) HTR1AHTR7TACR1ATP1A1ATP1B1
Hydrochloric Acid SCHEMBL6927670 0.96 TACR1 (0.34) HTR1AHTR7TACR1ATP1A1ATP1B1
Hydrochloric Acid SCHEMBL6923694 0.85 RXRA (0.32)
Hydrochloric Acid SCHEMBL7133093 0.85 TACR1 (0.34) HTR1AHTR7TACR1MEN1KMT2A
Hydrochloric Acid SCHEMBL6930149 0.81 TACR1 (0.37) HTR1AHTR7TACR1MEN1KMT2A
Hydrochloric Acid SCHEMBL6924045 0.81 TACR1 (0.37) HTR1AHTR7TACR1MEN1KMT2A
Hydrochloric Acid SCHEMBL6927081 0.81
SCHEMBL7939166 0.80 HTR1A (0.31) HTR1AHTR7TACR1MEN1KMT2A
SCHEMBL7939157 0.76 TACR1 (0.34) HTR1AHTR7TACR1
Hydrochloric Acid SCHEMBL8364207 0.75 TACR1 (0.33) HTR1AHTR7TACR1MEN1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020115805-A1 Methods of production of ethylene copolymers having narrow composition distributions and high melting temperatures THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2002-08-22 US disclosed
US-20010049425-A1 High-melting polyolefin copolymer elastomers, catalysts and methods of synthesis BP CORPORATION NORTH AMERICA INC. 2001-12-06 US disclosed