Hydrochloric Acid

Hydrochloric Acid

SCHEMBL9756650

C=Cc1ccc(NC(=O)C[N+](C)(C)C)cc1.[Cl-]

nearest known ligand 0.50

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 20)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 1/20 0.50
SCN2A Q99250 1/20 0.50
SCN3A Q9NY46 1/20 0.50
CYP1A2 P05177 2/20 0.45
CYP2C19 P33261 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
CYP2C9 P11712 1/20 0.45
NFKB1 P19838 1/20 0.45
PARP1 P09874 2/20 0.44
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
KDM4E B2RXH2 2/20 0.42
THRB P10828 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 2/20 0.40
ATM Q13315 1/20 0.39
TGM2 P21980 2/20 0.38
TP53 P04637 1/20 0.38
CA12 O43570 1/20 0.37

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
SCHEMBL832944 0.78 MAPT (0.57) CYP1A2CYP2C19MEN1KMT2AALDH1A1
SCHEMBL9113346 0.76 MAOB (0.45) MEN1KMT2AALDH1A1KDM4ETHRB
SCHEMBL13112978 0.76 POLB (0.46) MEN1KMT2AALDH1A1KDM4ETHRB
SCHEMBL8428153 0.76 NPC1 (0.58) MEN1KMT2AALDH1A1LMNAKDM4E
SCHEMBL13901427 0.75 SCN1A (0.76) SCN1ASCN2ASCN3ACYP1A2CYP2C19
SCHEMBL13101226 0.75 KMT2A (0.44) MEN1KMT2AALDH1A1KDM4ETHRB
SCHEMBL8426259 0.73 THRB (0.50) ALDH1A1KDM4ETHRBPOLBMAPT
SCHEMBL2056453 0.73 SMN1; SMN2 (0.59) CYP2C19MEN1KMT2AALDH1A1LMNA
SCHEMBL14301433 0.73 RAB9A (0.52) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL7653547 0.73 SCN1A (0.51) SCN1ASCN2ASCN3ACYP1A2CYP2C19

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
EP-0249991-B1 COLOR FILTER ARRAYS EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1991-08-28 EP disclosed
EP-0358439-A1 Improved magenta filters for filter arrays EASTMAN KODAK COMPANY (US) 1990-03-14 EP disclosed
EP-0249991-A2 Color filter arrays EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1987-12-23 EP disclosed
US-4247615-A DIAZO RESIN, MORDANT FOR ANIONIC DYE EASTMAN KODAK COMPANY (US) 1981-01-27 US disclosed
US-4220700-A MORDANTS, ANIONIC DYES EASTMAN KODAK COMPANY (US) 1980-09-02 US disclosed