Hydrochloric Acid

Hydrochloric Acid

SCHEMBL29205653

CC(C1=C([Zr+2])CC=C1)(c1ccccc1)c1ccccc1.[Cl-].[Cl-]

nearest known ligand 0.41

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 7)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.37
ESR2 Q92731 2/20 0.37
CYP2B6 P20813 1/20 0.34
MAPK1 P28482 1/20 0.32
TAAR1 Q96RJ0 1/20 0.31
ALDH1A1 P00352 1/20 0.31
ALOX15 P16050 1/20 0.31

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 SCHEMBL29205577 0.87 ALDH1A1 (0.38) ESR1ESR2CYP2B6MAPK1TAAR1
Hydrochloric Acid SCHEMBL29205541 0.80 MEN1 (0.32) TAAR1
Hydrochloric Acid SCHEMBL29205569 0.78 KCNN4 (0.34) ESR1ESR2
Hydrochloric Acid SCHEMBL29205648 0.77 KIF11 (0.33)
Hydrochloric Acid SCHEMBL29205654 0.75 ESR1 (0.37) ESR1ESR2CYP2B6MAPK1TAAR1
Hydrochloric Acid SCHEMBL6912160 0.74
SCHEMBL12814791 0.74 ESR1 (0.39) ESR1ESR2CYP2B6MAPK1TAAR1
Hydrochloric Acid SCHEMBL2358778 0.74 ESR1 (0.36) ESR1ESR2CYP2B6MAPK1
Hydrochloric Acid SCHEMBL16459779 0.68 ESR1 (0.37) ESR1ESR2CYP2B6MAPK1TAAR1
Hydrochloric Acid SCHEMBL2245745 0.68 ALDH1A1 (0.37) ESR1ESR2CYP2B6MAPK1TAAR1

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
CN-117795038-A Process for producing alpha-olefin oligomer composition 出光兴产株式会社 2024-03-29 CN disclosed