Hydrochloric Acid

Hydrochloric Acid

SCHEMBL9497972

CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1[N+]#N.[Cl-].[Cl-].[Cl-].[Zn+2]

nearest known ligand 0.65

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
MAPT P10636 8/20 0.65
GAA P10253 4/20 0.65
ALDH1A1 P00352 5/20 0.61
KDM4E B2RXH2 2/20 0.61
HDAC1 Q13547 2/20 0.57
HDAC8 Q9BY41 2/20 0.57
HDAC6 Q9UBN7 2/20 0.57
KMT2A Q03164 2/20 0.56
MEN1 O00255 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
LMNA P02545 1/20 0.54
MAPK1 P28482 1/20 0.51
AHR P35869 1/20 0.51
EPHX1 P07099 1/20 0.50
NPC1 O15118 1/20 0.49

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 SCHEMBL1785872 0.99 MAPT (0.67) MAPTGAAALDH1A1KDM4EHDAC1
Hydrochloric Acid SCHEMBL9818222 0.98 MAPT (0.65) MAPTGAAALDH1A1KDM4EHDAC1
Hydrochloric Acid SCHEMBL8414465 0.98 MAPT (0.65) MAPTGAAALDH1A1KDM4EHDAC1
SCHEMBL3315675 0.98 MAPT (0.65) MAPTGAAALDH1A1KDM4EHDAC1
SCHEMBL31256869 0.98 MAPT (0.65) MAPTGAAALDH1A1KDM4EHDAC1
Hydrochloric Acid SCHEMBL8414464 0.96 MAPT (0.64) MAPTGAAALDH1A1KDM4EHDAC1
Zinc Chloride SCHEMBL29476092 0.94 MAPT (0.65) MAPTGAAALDH1A1KDM4EHDAC1
SCHEMBL11410702 0.94 MAPT (0.64) MAPTGAAALDH1A1KDM4EHDAC1
Perchlorate SCHEMBL9816303 0.93 MAPT (0.60) MAPTGAAALDH1A1KDM4EHDAC1
SCHEMBL11436005 0.93 MAPT (0.63) MAPTGAAALDH1A1KDM4EHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0296289-B1 IMAGING MATERIAL SEIKO INSTRUMENTS INC. (JP) 1993-03-31 EP disclosed
US-5041356-A Optical card; high density recording DAI NIPPON INSATSU KABUSHIKI KAISHA (JP) 1991-08-20 US disclosed
EP-0158906-B1 OPTICAL CARD DAI NIPPON INSATSU KABUSHIKI KAISHA (JP) 1991-02-20 EP disclosed
US-4916042-A Multicolor imaging material SEIKO INSTRUMENTS INC. (JP) 1990-04-10 US disclosed
US-4816362-A MULTILAYER, LIGHT SENSITIVE ELEMENT DAI NIPPON INSATSU KABUSHIKI KAISHA (JP) 1989-03-28 US disclosed
EP-0296289-A2 Imaging material SEIKO INSTRUMENTS INC. (JP) 1988-12-28 EP disclosed
US-4673626-A Optical recording card with optical recording layers DAI NIPPON INSATSU KABUSHIKI KAISHA (JP) 1987-06-16 US disclosed