Hydrochloric Acid

Hydrochloric Acid

SCHEMBL9575715

CCCCCCCCCCCCCCCCCC(=O)NC[C@@H](COC(=O)CCC[n+]1ccccc1)OC(C)=O.[Cl-]

nearest known ligand 0.52

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
PRKCA P17252 3/20 0.52
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
NAPEPLD Q6IQ20 1/20 0.43
PRKCE Q02156 1/20 0.43
PRKCQ Q04759 1/20 0.43
PRKCD Q05655 1/20 0.43
MAPT P10636 1/20 0.41

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 SCHEMBL9575710 1.00 PRKCA (0.52) PRKCAALDH1A1LMNANAPEPLDPRKCE
Hydrochloric Acid SCHEMBL9575714 0.90 PRKCA (0.61) PRKCAALDH1A1LMNAPRKCEPRKCQ
Hydrochloric Acid SCHEMBL9575707 0.90 PRKCA (0.61) PRKCAALDH1A1LMNAPRKCEPRKCQ
Hydrochloric Acid SCHEMBL9575992 0.80 SMN1; SMN2 (0.43) PRKCAALDH1A1LMNAPRKCEPRKCQ
Hydrochloric Acid SCHEMBL9575994 0.80 SMN1; SMN2 (0.43) PRKCAALDH1A1LMNAPRKCEPRKCQ
Hydrochloric Acid SCHEMBL9575966 0.76 LMNA (0.45) ALDH1A1LMNA
Hydrochloric Acid SCHEMBL9575891 0.76 LMNA (0.45) ALDH1A1LMNA
Hydrochloric Acid SCHEMBL9575899 0.76 LMNA (0.45) ALDH1A1LMNA
Hydrochloric Acid SCHEMBL9575835 0.76 GMNN (0.52) LMNA
Hydrochloric Acid SCHEMBL9575957 0.75 ALDH1A1 (0.46) PRKCAALDH1A1LMNAPRKCEPRKCQ

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-5187293-A Blood platelet activating factor inhibitors HOFFMANN-LA ROCHE INC. (US) 1993-02-16 US disclosed
US-4731373-A BLOOD PLATELET ACTIVATING FACTOR HOFFMAN-LA ROCHE INC. (US) 1988-03-15 US disclosed