Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7092701

CC(C)(C)c1ccccc1N[Hf+2](C1c2ccccc2-c2ccccc21)[SiH](c1ccccc1)c1ccccc1.[Cl-].[Cl-]

nearest known ligand 0.32

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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 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.32
GAA P10253 1/20 0.32
THRB P10828 1/20 0.32
ALOX12 P18054 1/20 0.32
LPAR1 Q92633 1/20 0.31
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
GRIN2D O15399 1/20 0.30
GRIN3B O60391 1/20 0.30
GRIN1 Q05586 1/20 0.30
GRIN2A Q12879 1/20 0.30
GRIN2B Q13224 1/20 0.30
GRIN2C Q14957 1/20 0.30
GRIN3A Q8TCU5 1/20 0.30
SIGMAR1 Q99720 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 SCHEMBL6827117 0.81 POLB (0.34) POLBLPAR1
Hydrochloric Acid SCHEMBL5853648 0.80 PPIA (0.39) GAALMNA
Hydrochloric Acid SCHEMBL6861247 0.80 MEN1 (0.30) POLB
Hydrochloric Acid SCHEMBL7104426 0.79 KCNK18 (0.35) ALDH1A1
Hydrochloric Acid SCHEMBL6843687 0.78
Hydrochloric Acid SCHEMBL7107702 0.76
Hydrochloric Acid SCHEMBL5853382 0.74 CCKBR (0.33) POLBGAAALDH1A1LMNA
Hydrochloric Acid SCHEMBL6830301 0.74 FFAR4 (0.33) POLB
Hydrochloric Acid SCHEMBL6702088 0.73 KMT2A (0.34) POLBLMNA
Hydrochloric Acid SCHEMBL5855900 0.71 POLB (0.37) POLBGAATHRBALOX12ALDH1A1

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
WO-2004106394-A1 COPOLYMERS OF ETHYLENE AND/OR α-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-12-09 WO disclosed