Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7734558

[Cl-].[Cl-].c1coc(C2=C(c3cccc4ccccc34)c3ccccc3C2[Hf+2]C2C(c3ccco3)=C(c3cccc4ccccc34)c3ccccc32)c1

nearest known ligand 0.38

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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 20)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 1/20 0.32
MAPT P10636 5/20 0.34
KDM4E B2RXH2 3/20 0.34
KMT2A Q03164 2/20 0.34
CASP3 P42574 2/20 0.34
SENP8 Q96LD8 2/20 0.34
SENP7 Q9BQF6 2/20 0.34
SENP6 Q9GZR1 2/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
HSD17B10 Q99714 2/20 0.34
MEN1 O00255 1/20 0.34
TP53 P04637 1/20 0.34
GAA P10253 1/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
ALDH1A1 P00352 4/20 0.33
POLB P06746 2/20 0.33

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 SCHEMBL7061937 0.82 NOTUM (0.34) MAPTKDM4EKMT2ACASP3SENP8
Hydrochloric Acid SCHEMBL7728452 0.82 MAPT (0.34) MAPTKDM4EKMT2ACASP3SENP8
Hydrochloric Acid SCHEMBL5950993 0.77 ALDH1A1 (0.32) MAPTKDM4EKMT2ACASP3SENP8
Hydrochloric Acid SCHEMBL7734556 0.75 KDM4E (0.33) MAPTKDM4EKMT2ACASP3SENP8
Hydrochloric Acid SCHEMBL8079745 0.74 ALDH1A1 (0.36) MAPTKDM4EKMT2ACASP3SENP8
Hydrochloric Acid SCHEMBL6056185 0.73 ALDH1A1 (0.31) KMT2ASMN1; SMN2MEN1ALDH1A1POLB
SCHEMBL157996 0.72 KDM4E (0.46) MAPTKDM4EKMT2ACASP3SENP8
Hydrochloric Acid SCHEMBL5950595 0.69 KDM4E (0.30) KDM4EKMT2AALDH1A1POLBHTT
Hydrochloric Acid SCHEMBL7926714 0.69 MAPT (0.35) MAPTKDM4ECASP3SENP8SENP7
Hydrochloric Acid SCHEMBL7731502 0.68 ALDH1A1 (0.39) MAPTKDM4EKMT2ACASP3SENP8

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-6479646-B1 Metallocene compounds having indenyl ligand and catalysts for olefin polymerization containing the same CHISSO CORPORATION (JP) 2002-11-12 US disclosed