Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7733901

CC1=NC2=CC=CC2=C1.[Cl-].[Cl-].[Zr+2]C1=Cc2ccccc2C1c1ccccn1

nearest known ligand 0.31

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 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.31
HSD17B10 Q99714 2/20 0.31
ALDH1A1 P00352 2/20 0.31
CASP1 P29466 2/20 0.31
MAPT P10636 1/20 0.30

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 SCHEMBL7731131 0.86 KDM4E (0.33) KDM4EHSD17B10CASP1
Hydrochloric Acid SCHEMBL7730123 0.81
Hydrochloric Acid SCHEMBL7731912 0.70 KDM4E (0.30) KDM4EHSD17B10
Hydrochloric Acid SCHEMBL7723047 0.69 KDM4E (0.30) KDM4E
SCHEMBL28460906 0.68 ALDH1A1 (0.43) KDM4EHSD17B10ALDH1A1CASP1MAPT
Hydrochloric Acid SCHEMBL7722848 0.67
Hydrochloric Acid SCHEMBL7733539 0.65
Hydrochloric Acid SCHEMBL7735543 0.63
SCHEMBL6904701 0.63 ALDH1A1 (0.43) KDM4EHSD17B10ALDH1A1CASP1MAPT
SCHEMBL27992832 0.63 ALDH1A1 (0.43) KDM4EHSD17B10ALDH1A1CASP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6458982-B1 CATALYST SYSTEM COMPRISING AT LEAST ONE METALLOCENE AND AT LEAST ONE COCATALYST. ON SUPPORT. TARGOR GMBH (DE) 2002-10-01 US disclosed