Hydrochloric Acid

Hydrochloric Acid

SCHEMBL28520182

[Cl-].c1ccc(C[n+]2cc[nH]c2-c2ccccc2)cc1

nearest known ligand 0.43

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
LMNA P02545 2/20 0.43
KDM4E B2RXH2 4/20 0.38
ALDH1A1 P00352 3/20 0.38
RAB9A P51151 3/20 0.38
HPGD P15428 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
NPC1 O15118 2/20 0.38
MITF O75030 1/20 0.38
GLA P06280 1/20 0.38
GAA P10253 1/20 0.38
HTT P42858 1/20 0.38
PNP P00491 2/20 0.37
CYP2D6 P10635 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.35
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
DRD4 P21917 1/20 0.34
DRD3 P35462 1/20 0.34

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
SCHEMBL21409512 0.98 LMNA (0.41) LMNAKDM4EALDH1A1RAB9AHPGD
Fluoride Ion SCHEMBL28520178 0.96 LMNA (0.40) LMNAKDM4EALDH1A1RAB9AHPGD
Bromide SCHEMBL28909148 0.96 LMNA (0.40) LMNAKDM4EALDH1A1RAB9AHPGD
Iodide SCHEMBL28519463 0.96 LMNA (0.40) LMNAKDM4EALDH1A1RAB9AHPGD
SCHEMBL1082818 0.81 NPC1 (0.39) KDM4EALDH1A1RAB9AHPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL9696543 0.76 KDM4E (0.43) LMNAKDM4EALDH1A1RAB9AHPGD
Hydrochloric Acid SCHEMBL4053164 0.75 TAAR1 (0.41) LMNAKDM4EALDH1A1RAB9AHPGD
SCHEMBL5711144 0.74 KDM4E (0.41) LMNAKDM4EALDH1A1RAB9AHPGD
Hydrochloric Acid SCHEMBL20191168 0.74 TP53 (0.43) LMNAKDM4EALDH1A1RAB9AHPGD
Hydrochloric Acid SCHEMBL28388643 0.74 KDM4E (0.37) LMNAKDM4EALDH1A1RAB9AHPGD

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-107427869-B Heavy metal fixing agent for treating ash and method for treating ash using same 栗田工业株式会社 2021-02-02 CN disclosed