Hydrochloric Acid

Hydrochloric Acid

SCHEMBL9714744

N#CCC=CCc1cccc(C[P+](c2ccccc2)(c2ccccc2)c2ccccc2)c1.[Cl-]

nearest known ligand 0.38

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 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.38
SNCA P37840 2/20 0.36
ATM Q13315 1/20 0.35
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
APP P05067 1/20 0.33
HIF1A Q16665 1/20 0.31
MAOA P21397 1/20 0.31

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 SCHEMBL9714843 0.84 SNCA (0.36) MAOBSNCAATMMEN1KMT2A
Hydrochloric Acid SCHEMBL9714709 0.83 SNCA (0.36) MAOBSNCAAPPHIF1AMAOA
Hydrochloric Acid SCHEMBL9714813 0.79 ENPP2 (0.44) MAOBSNCAATMMEN1KMT2A
Hydrochloric Acid SCHEMBL5149449 0.78 SNCA (0.52) SNCAAPPHIF1AMAOA
Hydrochloric Acid SCHEMBL9714784 0.77 MEN1 (0.62) MAOBSNCAATMMEN1KMT2A
SCHEMBL11252440 0.77 MAOB (0.65) MAOBATMMEN1KMT2AMAOA
SCHEMBL11252427 0.77 MAOB (0.65) MAOBATMMEN1KMT2AMAOA
Bromide SCHEMBL6524406 0.75 SNCA (0.55) SNCAAPPHIF1AMAOA
Hydrochloric Acid SCHEMBL9714743 0.73 FOLH1 (0.48) MAOBSNCAMAOA
Hydrochloric Acid SCHEMBL9714580 0.73 MEN1 (0.35) MAOBSNCAMEN1KMT2AMAOA

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