Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7044171

O=C(N[Ti+2])C12CC3CC(CC(C3)C1)C2.[Cl-].[Cl-]

nearest known ligand 0.50

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 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.50
ALDH1A1 P00352 3/20 0.50
CRHBP P24387 1/20 0.50
CRHR2 Q13324 1/20 0.50
MCOLN3 Q8TDD5 1/20 0.50
GLA P06280 1/20 0.50
KDM4E B2RXH2 1/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
CYP17A1 P05093 1/20 0.45
CYP19A1 P11511 1/20 0.45
LMNA P02545 3/20 0.44
NPSR1 Q6W5P4 1/20 0.44
P2RX7 Q99572 1/20 0.44

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
SCHEMBL31053476 0.76 HTT (0.53) HTTALDH1A1CRHBPCRHR2MCOLN3
SCHEMBL28289553 0.76 ALDH1A1 (0.53) HTTALDH1A1CRHBPCRHR2MCOLN3
SCHEMBL1552389 0.74 MEN1 (0.63) HTTALDH1A1CRHBPCRHR2MCOLN3
SCHEMBL23220249 0.74 THRB (0.63) HTTALDH1A1CRHBPCRHR2MCOLN3
SCHEMBL2841738 0.74 THRB (0.63) HTTALDH1A1CRHBPCRHR2MCOLN3
Hydrochloric Acid SCHEMBL28131943 0.73 THRB (0.61) HTTALDH1A1CRHBPCRHR2MCOLN3
SCHEMBL14503267 0.73 EPHX2 (0.64) HTTALDH1A1CRHBPCRHR2MCOLN3
SCHEMBL3244876 0.71 HTT (0.48) HTTALDH1A1CRHBPCRHR2MCOLN3
SCHEMBL14382350 0.71 GLA (0.63) HTTALDH1A1CRHBPCRHR2MCOLN3
SCHEMBL28826584 0.71 EPHX1 (0.67) HTTALDH1A1CRHBPCRHR2MCOLN3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1296991-B1 SILOXY SUBSTITUTED COCATALYST ACTIVATORS FOR OLEFIN POLYMERIZATION EXXONMOBIL CHEM PATENTS INC (US) 2013-05-15 EP disclosed
EP-1296991-A1 SILOXY SUBSTITUTED COCATALYST ACTIVATORS FOR OLEFIN POLYMERIZATION ExxonMobil Chemical Patents Inc. (US) 2003-04-02 EP disclosed
EP-1297027-A1 SILOXY SUBSTITUTED COCATALYST ACTIVATORS FOR OLEFIN POLYMERIZATION Exxonmobil Chemical Patents Inc. (US) 2003-04-02 EP disclosed
WO-2002000738-A1 SILOXY SUBSTITUTED COCATALYST ACTIVATORS FOR OLEFIN POLYMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2002-01-03 WO disclosed
WO-2002000666-A1 SILOXY SUBSTITUTED COCATALYST ACTIVATORS FOR OLEFIN POLYMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2002-01-03 WO disclosed