Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7640280

CC(C)=[Zr+2](C1C(c2ccccc2)=Cc2c(-c3ccccc3)cccc21)C1C(c2ccccc2)=Cc2c(-c3ccccc3)cccc21.[Cl-].[Cl-]

nearest known ligand 0.31

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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 11)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.31
PDCD1 Q15116 1/20 0.31
CD274 Q9NZQ7 1/20 0.31
EDNRB P24530 1/20 0.30
EDNRA P25101 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
BCL2L1 Q07817 1/20 0.30
HSD17B10 Q99714 1/20 0.30
CHRNB2 P17787 1/20 0.30
CHRNA4 P43681 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 SCHEMBL6465891 0.86 PDCD1 (0.34) PDCD1CD274ALDH1A1HPGDBCL2L1
Hydrochloric Acid SCHEMBL3836409 0.80 CHRNB2 (0.30) CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL31571599 0.80 CHRNB2 (0.30) CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL6909767 0.79 CYP11B1 (0.35)
Hydrochloric Acid SCHEMBL6056139 0.75
Hydrochloric Acid SCHEMBL6056222 0.75
Hydrochloric Acid SCHEMBL7637755 0.73 CYP11B1 (0.32)
SCHEMBL28438823 0.73 CHRNB2 (0.33) BRD4PDCD1CD274CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL7929729 0.72 PDCD1 (0.33) PDCD1CD274
Hydrochloric Acid SCHEMBL27450819 0.72 CHRNB2 (0.34) ALDH1A1HPGDBCL2L1HSD17B10CHRNB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6472490-B1 AN ETHYLENE-AROMATIC VINYL COMPOUND COPOLYMER HAVING AN AROMATIC VINYL COMPOUND CONTENT OF FROM 1 TO LESS THAN 55% BY MOLAR FRACTION, WHICH HAS A HAZE OF AT MOST 41.5% WHEN MOLDED; METHINE DYES DENKI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2002-10-29 US disclosed
US-6348556-B1 COORDINATION CATALYST OF TRANSITION METAL COMPLEX CONTAINING INDENYL GROUP(S) AND COCATALYST; ISOTACTIC; CATALYSIS, ADDITION COPOLYMERIZATION DENKI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2002-02-19 US disclosed
US-6066709-A Ethylene-aromatic vinyl compound copolymer and method for its production DENKI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2000-05-23 US disclosed
US-5883213-A STEREOREGULARITY DENKI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1999-03-16 US disclosed