Hydrochloric Acid

Hydrochloric Acid

SCHEMBL9714757

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

nearest known ligand 0.37

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 18)

geneUniProtsupporting neighboursconfidence
SNCA P37840 2/20 0.34
NLRP3 Q96P20 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
APP P05067 1/20 0.32
TBXAS1 P24557 1/20 0.31
CTSS P25774 2/20 0.31
CTSK P43235 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31
RAB9A P51151 1/20 0.31
GRIK1 P39086 1/20 0.31
GRIK2 Q13002 1/20 0.31
KDM4E B2RXH2 1/20 0.31
CTSL P07711 1/20 0.30
CTSB P07858 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 SCHEMBL9714580 0.78 MEN1 (0.35) SNCAMEN1KMT2AALDH1A1KDM4E
SCHEMBL2247673 0.77 TSHR (0.41) MEN1KMT2ANPC1ALDH1A1MAPT
SCHEMBL2247670 0.77 TSHR (0.41) MEN1KMT2ANPC1ALDH1A1MAPT
SCHEMBL9714753 0.75 NLRP3 (0.33) SNCANLRP3MEN1KMT2AAPP
Hydrochloric Acid SCHEMBL9714709 0.75 SNCA (0.36) SNCAAPPALDH1A1KDM4E
Hydrochloric Acid SCHEMBL9714784 0.74 MEN1 (0.62) SNCAMEN1KMT2AAPPCTSS
SCHEMBL12231441 0.74 KMT2A (0.41) MEN1KMT2ANPC1ALDH1A1MAPT
SCHEMBL12231439 0.74 KMT2A (0.41) MEN1KMT2ANPC1ALDH1A1MAPT
Hydrochloric Acid SCHEMBL9714808 0.71 GUSB (0.39)
Hydrochloric Acid SCHEMBL9714813 0.70 ENPP2 (0.44) SNCAMEN1KMT2AAPPKDM4E

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