Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5853353

Cc1cc(C)c(C(=O)N[Zr+2](C2c3ccccc3-c3ccccc32)[SiH](C)C)c(C)c1.[Cl-].[Cl-]

nearest known ligand 0.40

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 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.40
LMNA P02545 3/20 0.37
MEN1 O00255 1/20 0.37
TP53 P04637 1/20 0.36
TAS1R3 Q7RTX0 4/20 0.35
TAS1R1 Q7RTX1 4/20 0.35
TAS1R2 Q8TE23 4/20 0.35
ALDH1A1 P00352 1/20 0.35
PPIA P62937 2/20 0.35
HDAC3 O15379 1/20 0.31
HDAC4 P56524 1/20 0.31
HDAC7 Q8WUI4 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
HDAC9 Q9UKV0 1/20 0.31
HDAC5 Q9UQL6 1/20 0.31
NCOR2 Q9Y618 1/20 0.31
LCK P06239 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 SCHEMBL5854561 0.90 TAS1R3 (0.39) KMT2ALMNAMEN1TAS1R3TAS1R1
Hydrochloric Acid SCHEMBL5855021 0.87 KMT2A (0.38) KMT2ALMNAMEN1TP53TAS1R3
Hydrochloric Acid SCHEMBL5852810 0.86 MEN1 (0.41) KMT2ALMNAMEN1TP53TAS1R3
Hydrochloric Acid SCHEMBL5853072 0.82 HPGD (0.40) KMT2ALMNAMEN1ALDH1A1
Hydrochloric Acid SCHEMBL5853447 0.81 SMN1; SMN2 (0.46) KMT2ALMNAMEN1HDAC8HDAC6
Hydrochloric Acid SCHEMBL5854943 0.80 KMT2A (0.41) KMT2ALMNAMEN1ALDH1A1HDAC3
Hydrochloric Acid SCHEMBL5854729 0.79 KMT2A (0.35) KMT2ALMNAMEN1PPIAHDAC3
Hydrochloric Acid SCHEMBL5854099 0.79 KMT2A (0.37) KMT2ALMNATP53TAS1R3TAS1R1
Hydrochloric Acid SCHEMBL5855206 0.78 POLB (0.40) KMT2ALMNAMEN1ALDH1A1HDAC3
Hydrochloric Acid SCHEMBL5852898 0.78 HDAC3 (0.35) KMT2ALMNAMEN1ALDH1A1HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7037989-B2 Copolymers of ethylene and/or α-olefins and vicinally disubstituted olefins EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-05-02 US disclosed
WO-2004106394-A1 COPOLYMERS OF ETHYLENE AND/OR α-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-12-09 WO disclosed
US-20040242814-A1 COPOLYMERS OF ETHYLENE AND/OR ALPHA-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. 2004-12-02 US disclosed