Hydrochloric Acid

Hydrochloric Acid

SCHEMBL8677643

CCO[Zr+]1C2C(=Cc3ccccc32)CCC2=Cc3ccccc3C21.[Cl-]

nearest known ligand 0.34

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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 6)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
KDM1A O60341 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
HTR2B P41595 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 SCHEMBL7899797 0.80 CYP11B1 (0.34) CYP11B1CYP11B2KDM1A
Hydrochloric Acid SCHEMBL7525476 0.77 KDM1A (0.35) CYP11B1CYP11B2KDM1A
SCHEMBL4453972 0.69 DRD2 (0.35) CYP11B1CYP11B2KDM1AHTR2AHTR2C
Hydrochloric Acid SCHEMBL8681554 0.68
SCHEMBL6355473 0.65 CYP11B1 (0.35) CYP11B1CYP11B2KDM1A
SCHEMBL4323019 0.65 CYP11B1 (0.35) CYP11B1CYP11B2KDM1A
Hydrochloric Acid SCHEMBL7770534 0.64 KDM1A (0.35) CYP11B1CYP11B2KDM1A
Hydrochloric Acid SCHEMBL217217 0.63 KDM1A (0.37) CYP11B1CYP11B2KDM1A
Hydrochloric Acid SCHEMBL3645288 0.63 KDM1A (0.37) CYP11B1CYP11B2KDM1A
Hydrochloric Acid SCHEMBL6764904 0.63 KDM1A (0.37) CYP11B1CYP11B2KDM1A

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-5807801-A Catalyst for the polymerization of alpha-olefins MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1998-09-15 US disclosed
EP-0250601-B1 PROCESS FOR POLYMERIZATION OF ALPHA-OLEFINS MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1992-02-26 EP disclosed
EP-0250601-A1 CATALYST FOR POLYMERIZATION OF ALPHA-OLEFINS. MITSUI PETROCHEMICAL IND (JP) 1988-01-07 EP disclosed
WO-1987003887-A1 PROCESS FOR POLYMERIZATION OF ALPHA-OLEFINS MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1987-07-02 WO disclosed