Hydrochloric Acid

Hydrochloric Acid

SCHEMBL27546014

C1=C([Hf+2]C2=CC(c3cccc4ccccc34)=CC2)CC=C1c1cccc2ccccc12.[Cl-].[Cl-]

nearest known ligand 0.38

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
NISCH Q9Y2I1 1/20 0.38
KDM4E B2RXH2 6/20 0.36
GAA P10253 2/20 0.36
PTPN1 P18031 1/20 0.36
ALPL P05186 1/20 0.36
ALDH1A1 P00352 7/20 0.35
MAPT P10636 5/20 0.35
HPGD P15428 5/20 0.35
HSD17B10 Q99714 5/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
MAPK1 P28482 3/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
LMNA P02545 2/20 0.35
GSK3B P49841 1/20 0.35
CDK5 Q00535 1/20 0.35
CDK5R1 Q15078 1/20 0.35
TSHR P16473 3/20 0.34
TP53 P04637 2/20 0.34
TDP1 Q9NUW8 2/20 0.34

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 SCHEMBL7926454 0.93 NISCH (0.34) NISCHKDM4EGAAPTPN1ALPL
SCHEMBL1029739 0.77 SLC6A3 (0.40) NISCHKDM4EGAAPTPN1ALPL
Hydrochloric Acid SCHEMBL27537067 0.77 NISCH (0.38) NISCHKDM4EGAAPTPN1ALPL
SCHEMBL19593316 0.72 PTPN1 (0.41) NISCHKDM4EGAAPTPN1ALPL
Hydrochloric Acid SCHEMBL7938955 0.71 NISCH (0.34) NISCHKDM4EGAAPTPN1ALPL
Hydrochloric Acid SCHEMBL7935976 0.69 NISCH (0.33) NISCHKDM4EGAAPTPN1ALPL
Hydrochloric Acid SCHEMBL7935997 0.69 NISCH (0.33) NISCHKDM4EGAAPTPN1ALPL
Hydrochloric Acid SCHEMBL7938961 0.69 PTPN1 (0.33) NISCHKDM4EGAAPTPN1ALPL
SCHEMBL1821397 0.68 SLC6A3 (0.38) NISCHKDM4EGAAPTPN1ALPL
SCHEMBL3388511 0.68 HPRT1 (0.44) ALDH1A1MAPTHPGDHSD17B10MAPK1

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
CN-1274359-A Mu-oxometallocene complex compound, and olefin polymerization catalyst and polymerization method using same CHISSO CORP (JP) 2000-11-22 CN disclosed
CN-1274360-A Processes for prepn. of metallocene complexes CHISSO CORP (JP) 2000-11-22 CN disclosed