Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7715857

CC1=C(C)C(C)C([Si](C)(C)NC(=O)c2ccc(F)cc2)=C1C.[Cl-].[Cl-].[Zr+2]

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 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
KDM4E B2RXH2 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 2/20 0.36
ADCY1 Q08828 1/20 0.36
HTT P42858 1/20 0.36
ALDH1A1 P00352 2/20 0.35
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
GAA P10253 1/20 0.35
KCNMA1 Q12791 1/20 0.35

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
SCHEMBL6438161 0.73 POLB (0.33) RAB9ASMN1; SMN2ALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL7641403 0.68 SMN1; SMN2 (0.36) NPC1RAB9AKDM4EL3MBTL1SMN1; SMN2
SCHEMBL8849976 0.63 LOXL2 (0.33) SMN1; SMN2HTTGAA
SCHEMBL12816288 0.62 PTGS2 (0.31) GAA
Hydrochloric Acid SCHEMBL17836052 0.61
SCHEMBL12817753 0.61 ESR1 (0.31)
SCHEMBL13178144 0.61 SMN1; SMN2 (0.56) RAB9AL3MBTL1SMN1; SMN2LMNAALDH1A1
SCHEMBL7927391 0.60 SMN1; SMN2 (0.38) NPC1RAB9AKDM4ESMN1; SMN2LMNA
SCHEMBL192212 0.60 HDAC2 (0.64) NPC1RAB9ASMN1; SMN2HTTMEN1
SCHEMBL12441886 0.60 HDAC2 (0.64) NPC1RAB9ASMN1; SMN2HTTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6376416-B1 COORDINATION POLYMERIZATION CATALYSTS JAPAN POLYCHEM CORPORATION (JP) 2002-04-23 US disclosed