Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5854492

CC1=CCC([Zr+2](NC(=O)c2cc(C)cc(C)c2)[SiH](C)C)=C1.[Cl-].[Cl-]

nearest known ligand 0.33

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 13)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.33
TAS1R1 Q7RTX1 1/20 0.33
TAS1R2 Q8TE23 1/20 0.33
GAA P10253 1/20 0.33
POLB P06746 2/20 0.33
TPMT P51580 1/20 0.32
NPC1 O15118 1/20 0.32
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
THRB P10828 1/20 0.31
TDP1 Q9NUW8 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 SCHEMBL5853474 0.80
Hydrochloric Acid SCHEMBL5853300 0.78 HDAC8 (0.40) GAARAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL5856483 0.77 TAS1R3 (0.32) TAS1R3TAS1R1TAS1R2
Hydrochloric Acid SCHEMBL5854357 0.76
Hydrochloric Acid SCHEMBL5855526 0.76
Hydrochloric Acid SCHEMBL5855807 0.74 KCNK3 (0.37) GAAALDH1A1TDP1
Hydrochloric Acid SCHEMBL5855378 0.74 TP53 (0.30)
Hydrochloric Acid SCHEMBL5855917 0.73 NPSR1 (0.39) GAARAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL5853328 0.72 HPGD (0.33) POLBALDH1A1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL5855858 0.72 NPSR1 (0.38) GAANPC1RAB9ASMN1; SMN2

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 2 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
US-20040242814-A1 COPOLYMERS OF ETHYLENE AND/OR ALPHA-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. 2004-12-02 US disclosed