Hydrochloric Acid

Hydrochloric Acid

SCHEMBL727581

CC(C)(C)c1cccc(C(C)(C)C)c1OC[Al+2].[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 20)

geneUniProtsupporting neighboursconfidence
NAMPT known ✓ P43490 1/20 0.33
CA2 P00918 1/20 0.41
ALDH1A1 P00352 6/20 0.41
KDM4E B2RXH2 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GABRA1 P14867 1/20 0.36
GABRB2 P47870 1/20 0.36
TDP1 Q9NUW8 2/20 0.35
TSHR P16473 1/20 0.35
NISCH Q9Y2I1 1/20 0.34
GAA P10253 2/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
HSD17B10 Q99714 1/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
NR1H4 Q96RI1 1/20 0.32
ALOX5AP P20292 1/20 0.32

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 SCHEMBL8859896 0.78 CYP2D6 (0.45) CA2ALDH1A1SMN1; SMN2CYP2D6CYP2C19
SCHEMBL8600022 0.77 CA2 (0.43) CA2ALDH1A1KDM4ESMN1; SMN2GABRA1
SCHEMBL5968095 0.77 CA2 (0.48) CA2ALDH1A1KDM4ESMN1; SMN2GABRA1
SCHEMBL3367136 0.77 CA2 (0.43) CA2ALDH1A1KDM4ESMN1; SMN2GABRA1
SCHEMBL28336905 0.76 CA2 (0.39) CA2ALDH1A1KDM4ESMN1; SMN2GABRA1
Hydrochloric Acid SCHEMBL8859900 0.76 PTGDR2 (0.38) CYP2D6
Hydrochloric Acid SCHEMBL727522 0.76 CA2 (0.46) CA2ALDH1A1KDM4ESMN1; SMN2GABRA1
Hydrochloric Acid SCHEMBL28336908 0.75 CA2 (0.41) CA2ALDH1A1KDM4ESMN1; SMN2GABRA1
SCHEMBL27511682 0.75 ALDH1A1 (0.47) CA2ALDH1A1KDM4ESMN1; SMN2GABRA1
SCHEMBL6473114 0.73 CA2 (0.40) CA2ALDH1A1KDM4ESMN1; SMN2GABRA1

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 242 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3765471-A1 NOVEL VINYL PHOSPHINES AND PHOTO-INITIATORS OBTAINABLE THEREFROM Grützmacher, Hansjörg (CH) 2021-01-20 EP claimed
CN-112154149-A Novel vinylphosphines and photoinitiators obtainable therefrom 汉斯约尔格·格吕茨马赫 2020-12-29 CN claimed
WO-2019175319-A1 NOVEL VINYL PHOSPHINES AND PHOTO-INITIATORS OBTAINABLE THEREFROM ETH ZURICH (CH) 2019-09-19 WO claimed
EP-1572752-B1 POLYMERIZATION PROCESSES EXXONMOBIL CHEM PATENTS INC (US) 2014-08-13 EP claimed
EP-1578806-B1 POLYMERIZATION PROCESSES EXXONMOBIL CHEM PATENTS INC (US) 2013-05-22 EP claimed
EP-1761574-B1 POLYMERIZATION PROCESS USING HYDROFLUOROCARBONS EXXONMOBIL CHEM PATENTS INC (US) 2012-06-13 EP claimed
EP-1572753-B1 POLYMERIZATION PROCESSES EXXONMOBIL CHEM PATENTS INC (US) 2012-06-13 EP claimed
US-8178465-B2 Polydispersity-controlled isoolefin polymerization with polymorphogenates EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-05-15 US claimed
JP-4729040-B2 2011-07-20 JP claimed
US-20110111950-A1 Polydispersity-Controlled Isoolefin Polymerization With Polymorphogenates EXXONMOBIL CHEMICAL PATENTS INC. 2011-05-12 US claimed
EP-1572763-A2 POLYMERS WITH NEW SEQUENCE DISTRIBUTIONS ExxonMobil Chemical Patents Inc. (US) 2005-09-14 EP claimed
US-20050107536-A1 Polymers with new sequence distributions EXXONMOBIL CHEMICAL PATENTS INC. 2005-05-19 US claimed
US-20050101751-A1 Halogenated polymers with new sequence distributions EXXONMOBIL CHEMICAL PATENTS INC. 2005-05-12 US claimed
WO-2004067577-A2 POLYMERIZATION PROCESSES EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-08-12 WO claimed
WO-2004058829-A1 POLYMERIZATION PROCESSES EXXONMOBIL CHEMICAL PATENTS, INC. (US) 2004-07-15 WO claimed
WO-2004058836-A1 POLYMERS WITH NEW SEQUENCE DISTRIBUTIONS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-07-15 WO claimed
WO-2004058825-A2 POLYMERS WITH NEW SEQUENCE DISTRIBUTIONS EXXONMOBIL CHEMICAL PATENTS, INC. (US) 2004-07-15 WO claimed
WO-2004058828-A1 POLYMERIZATION PROCESSES EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-07-15 WO claimed
WO-2004058827-A1 POLYMERIZATION PROCESSES EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-07-15 WO claimed
WO-2004058835-A1 POLYMERS SUBSTANTIALLY FREE OF LONG CHAIN BRANCHING EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-07-15 WO claimed