Hydrochloric Acid

Hydrochloric Acid

SCHEMBL9714709

N#CCC=Cc1cccc(C[P+](c2ccccc2)(c2ccccc2)c2ccccc2)c1.[Cl-]

nearest known ligand 0.36

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 14)

geneUniProtsupporting neighboursconfidence
SNCA P37840 2/20 0.36
MAOB P27338 2/20 0.35
MAOA P21397 1/20 0.35
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
PKM P14618 1/20 0.32
LCK P06239 1/20 0.31
NOS2 P35228 1/20 0.31
CYP4F2 P78329 1/20 0.31
CYP4A11 Q02928 1/20 0.31
CHRNA7 P36544 1/20 0.31
HIF1A Q16665 1/20 0.31
APP P05067 1/20 0.30
HTR2A P28223 3/20 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 SCHEMBL9714580 0.86 MEN1 (0.35) SNCAMAOBMAOAKDM4EALDH1A1
Hydrochloric Acid SCHEMBL9714744 0.83 MAOB (0.38) SNCAMAOBMAOAHIF1AAPP
Hydrochloric Acid SCHEMBL9714813 0.76 ENPP2 (0.44) SNCAMAOBKDM4EHIF1AAPP
Hydrochloric Acid SCHEMBL4614799 0.76 ALDH1A1 (0.42) SNCAMAOBMAOAALDH1A1CHRNA7
SCHEMBL28373742 0.76 MMP3 (0.47) MAOBMAOAKDM4ECYP4F2CYP4A11
Hydrochloric Acid SCHEMBL5149449 0.75 SNCA (0.52) SNCAMAOAALDH1A1HIF1AAPP
Hydrochloric Acid SCHEMBL9714757 0.75 SNCA (0.34) SNCAKDM4EALDH1A1APP
Hydrochloric Acid SCHEMBL9714784 0.74 MEN1 (0.62) SNCAMAOBMAOAHIF1AAPP
Hydrochloric Acid SCHEMBL9714843 0.73 SNCA (0.36) SNCAMAOBHIF1AAPP
Hydrochloric Acid SCHEMBL9714743 0.73 FOLH1 (0.48) SNCAMAOBMAOAALDH1A1

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-5166210-A QUINOLINE DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D4 RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1992-11-24 US disclosed
US-5028615-A Treatment of hypersensitivity RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1991-07-02 US disclosed