Hydrochloric Acid

Hydrochloric Acid

SCHEMBL9714580

N#CCCC=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 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
SNCA P37840 2/20 0.34
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
PKM P14618 1/20 0.31
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
LCK P06239 1/20 0.30
NOS2 P35228 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 SCHEMBL9714709 0.86 SNCA (0.36) SNCAKDM4EALDH1A1PKMMAOA
Hydrochloric Acid SCHEMBL9714757 0.78 SNCA (0.34) MEN1KMT2ASNCAKDM4EALDH1A1
Hydrochloric Acid SCHEMBL9714784 0.77 MEN1 (0.62) MEN1KMT2ASNCAMAOAMAOB
SCHEMBL27280793 0.74 SIGMAR1 (0.46) MAOAMAOB
Hydrochloric Acid SCHEMBL9714813 0.74 ENPP2 (0.44) MEN1KMT2ASNCAKDM4EMAOB
Hydrochloric Acid SCHEMBL4614799 0.74 ALDH1A1 (0.42) SNCAALDH1A1MAOAMAOB
Hydrochloric Acid SCHEMBL9714744 0.73 MAOB (0.38) MEN1KMT2ASNCAMAOAMAOB
SCHEMBL9714573 0.73 MEN1 (0.34) MEN1KMT2ASNCAKDM4EALDH1A1
Hydrochloric Acid SCHEMBL5149449 0.73 SNCA (0.52) SNCAALDH1A1MAOA
Hydrochloric Acid SCHEMBL9714808 0.72 GUSB (0.39)

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 5 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
EP-0397697-A4 QUINOLINE DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D 4? 1991-07-03 EP disclosed
US-5028615-A Treatment of hypersensitivity RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1991-07-02 US disclosed
EP-0397697-A1 QUINOLINE DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D 4?. RORER INT OVERSEAS (US) 1990-11-22 EP disclosed
WO-1989004304-A1 QUINOLINE DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D4 RORER INTERNATIONAL (OVERSEAS) INC. (US) 1989-05-18 WO disclosed