Hydrochloric Acid

Hydrochloric Acid

SCHEMBL28109784

C[N+]1(Cc2ccccc2)CCCCC1.[Cl-].[Cl-].[Na+]

nearest known ligand 0.58

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
CHRM3 known ✓ P20309 2/20 0.41
CHRM2 known ✓ P08172 1/20 0.41
CHRM1 known ✓ P11229 1/20 0.41
CHRNB2 P17787 2/20 0.58
CHRNA4 P43681 2/20 0.58
CHRNA7 P36544 6/20 0.56
APOBEC3A P31941 3/20 0.46
APOBEC3G Q9HC16 3/20 0.46
PABPC1 P11940 2/20 0.46
EIF4H Q15056 1/20 0.46
ALDH1A1 P00352 2/20 0.44
HPGD P15428 1/20 0.44
KMT2A Q03164 1/20 0.44
MAPT P10636 1/20 0.43
CHRM4 P08173 1/20 0.41
CHRM5 P08912 1/20 0.41
KDM4E B2RXH2 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
CCR5 P51681 3/20 0.39
CYP2D6 P10635 1/20 0.39

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 SCHEMBL723900 0.98 CHRNB2 (0.59) CHRNB2CHRNA4CHRNA7APOBEC3AAPOBEC3G
Hydrochloric Acid SCHEMBL2458828 0.96 CHRNA7 (0.58) CHRNB2CHRNA4CHRNA7APOBEC3AAPOBEC3G
SCHEMBL10256901 0.96 CHRNB2 (0.61) CHRNB2CHRNA4CHRNA7APOBEC3AAPOBEC3G
SCHEMBL724930 0.96 CHRNB2 (0.61) CHRNB2CHRNA4CHRNA7APOBEC3AAPOBEC3G
Bromide SCHEMBL2450495 0.94 CHRNB2 (0.59) CHRNB2CHRNA4CHRNA7APOBEC3AAPOBEC3G
Water SCHEMBL8939227 0.94 CHRNB2 (0.59) CHRNB2CHRNA4CHRNA7APOBEC3AAPOBEC3G
Water SCHEMBL723735 0.94 CHRNB2 (0.59) CHRNB2CHRNA4CHRNA7APOBEC3AAPOBEC3G
Iodide SCHEMBL11507837 0.94 CHRNB2 (0.65) CHRNB2CHRNA4CHRNA7APOBEC3AAPOBEC3G
SCHEMBL3681307 0.94 CHRNA7 (0.60) CHRNB2CHRNA4CHRNA7APOBEC3AAPOBEC3G
Water SCHEMBL8939226 0.92 CHRNB2 (0.58) CHRNB2CHRNA4CHRNA7APOBEC3AAPOBEC3G

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
CN-106062035-A Polycondensation resin and optical film formed therefrom 三菱化学株式会社 2016-10-26 CN disclosed