Hydrochloric Acid

Hydrochloric Acid

SCHEMBL9549110

CCCCCCCCCCCC(=O)NCCC[N+](C)(C)CN1CCCC1=O.[Cl-]

nearest known ligand 0.42

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 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.42
GAA P10253 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
DNM1 Q05193 2/20 0.40
MAPK1 P28482 1/20 0.40
CASP2 P42575 1/20 0.40
OPRD1 P41143 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
RAB9A P51151 1/20 0.38
NAAA Q02083 1/20 0.38

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 SCHEMBL9549206 1.00 FAAH (0.42) FAAHGAAKDM4EALDH1A1HPGD
Hydrochloric Acid SCHEMBL9549323 1.00 FAAH (0.42) FAAHGAAKDM4EALDH1A1HPGD
Hydrochloric Acid SCHEMBL9549510 1.00 FAAH (0.42) FAAHGAAKDM4EALDH1A1HPGD
Hydrochloric Acid SCHEMBL9067351 1.00 FAAH (0.42) FAAHGAAKDM4EALDH1A1HPGD
Hydrochloric Acid SCHEMBL9549305 1.00 FAAH (0.42) FAAHGAAKDM4EALDH1A1HPGD
SCHEMBL9549652 0.99 FAAH (0.43) FAAHGAAKDM4EALDH1A1HPGD
SCHEMBL9549259 0.99 FAAH (0.43) FAAHGAAKDM4EALDH1A1HPGD
SCHEMBL9549107 0.99 FAAH (0.43) FAAHGAAKDM4EALDH1A1HPGD
Bromide SCHEMBL10392977 0.98 FAAH (0.42) FAAHGAAKDM4EALDH1A1HPGD
Hydrochloric Acid SCHEMBL9549050 0.94 GAA (0.41) FAAHGAAKDM4EALDH1A1HPGD

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0288515-B1 QUATERNIZED NITROGEN CONTAINING COMPOUNDS ISP INVESTMENTS INC. (US) 1993-05-05 EP claimed
EP-0288515-A4 QUATERNIZED NITROGEN CONTAINING COMPOUNDS 1990-09-26 EP claimed
US-4837013-A VISCOSITY ENHANCING AND HAIR CONDITIONING PROPERTIES GAF CORPORATION (US) 1989-06-06 US claimed
EP-0288515-A1 QUATERNIZED NITROGEN CONTAINING COMPOUNDS. GAF CORP (US) 1988-11-02 EP claimed
WO-1988002985-A1 QUATERNIZED NITROGEN CONTAINING COMPOUNDS GAF CORPORATION (US) 1988-05-05 WO claimed
EP-0288515-B1 QUATERNIZED NITROGEN CONTAINING COMPOUNDS ISP INVESTMENTS INC. (US) 1993-05-05 EP disclosed
EP-0288515-A4 QUATERNIZED NITROGEN CONTAINING COMPOUNDS 1990-09-26 EP disclosed
US-4837013-A VISCOSITY ENHANCING AND HAIR CONDITIONING PROPERTIES GAF CORPORATION (US) 1989-06-06 US disclosed
EP-0288515-A1 QUATERNIZED NITROGEN CONTAINING COMPOUNDS. GAF CORP (US) 1988-11-02 EP disclosed
WO-1988002985-A1 QUATERNIZED NITROGEN CONTAINING COMPOUNDS GAF CORPORATION (US) 1988-05-05 WO disclosed