Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5616348

CC1(C)c2cccc3c2C([Ti+2]C2c4ccccc4-c4cccc1c42)c1ccccc1-3.[Cl-].[Cl-]

nearest known ligand 0.39

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
CHRM2 known ✓ P08172 1/20 0.30
CHRM1 known ✓ P11229 1/20 0.30
CHRM3 known ✓ P20309 1/20 0.30
SLC6A2 known ✓ P23975 1/20 0.30
HTR2A P28223 2/20 0.39
GPR3 P46089 1/20 0.32
POLB P06746 1/20 0.32
MLNR O43193 1/20 0.30
NR1I2 O75469 1/20 0.30
ADRB1 P08588 1/20 0.30
HTR1A P08908 1/20 0.30
ADRA2A P08913 1/20 0.30
DRD2 P14416 1/20 0.30
ADRA2B P18089 1/20 0.30
ADRA2C P18825 1/20 0.30
DRD1 P21728 1/20 0.30
HTR2C P28335 1/20 0.30
SLC6A4 P31645 1/20 0.30
ADRA1A P35348 1/20 0.30
HRH1 P35367 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 SCHEMBL3352462 0.73 GPR3 (0.32) GPR3POLB
Hydrochloric Acid SCHEMBL5616477 0.72 HTR1A (0.38) HTR2AHTR1ADRD2
Hydrochloric Acid SCHEMBL5616436 0.69 ALDH1A1 (0.31) HTR2AGPR3POLB
SCHEMBL18590940 0.67 HTR2A (0.40) HTR2ASLC6A2HTR2CSLC6A4PDK2
Hydrochloric Acid SCHEMBL5616377 0.66 BRD4 (0.31)
SCHEMBL283246 0.64 HTR2A (0.48) HTR2AMLNRNR1I2CHRM2ADRB1
SCHEMBL29363404 0.64 HTR2A (0.48) HTR2AMLNRNR1I2CHRM2ADRB1
SCHEMBL24729587 0.62 HTR2A (0.47) HTR2AMLNRNR1I2CHRM2ADRB1
Benzene SCHEMBL28919541 0.62 PGR (0.48) HTR2AMLNRNR1I2CHRM2ADRB1
Lithium SCHEMBL30363455 0.62 HTR2A (0.47) HTR2AMLNRNR1I2CHRM2ADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007023618-A1 HOMOPOLYMER AND COPOLYMER, AND PRODUCTION PROCESS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-03-01 WO disclosed