Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5856483

CC1=CCC([Zr+2](NC(=O)c2c(C)cccc2C)[SiH](C)C)=C1.[Cl-].[Cl-]

nearest known ligand 0.32

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 6)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
TAS1R2 Q8TE23 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TYK2 P29597 1/20 0.32
F2R P25116 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 SCHEMBL5854059 0.86 HPGD (0.39) L3MBTL1TYK2
Hydrochloric Acid SCHEMBL5855765 0.82 TAS1R3 (0.32) TAS1R3TAS1R1TAS1R2L3MBTL1TYK2
Hydrochloric Acid SCHEMBL5853474 0.79
Hydrochloric Acid SCHEMBL5855807 0.79 KCNK3 (0.37)
Hydrochloric Acid SCHEMBL5854357 0.78
Hydrochloric Acid SCHEMBL5855526 0.75
Hydrochloric Acid SCHEMBL5855378 0.73 TP53 (0.30)
Hydrochloric Acid SCHEMBL5855917 0.72 NPSR1 (0.39)
Hydrochloric Acid SCHEMBL5853328 0.71 HPGD (0.33)
Hydrochloric Acid SCHEMBL5852845 0.71 TAS1R3 (0.32) TAS1R3TAS1R1TAS1R2L3MBTL1TYK2

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