Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7930461

CC1=C(c2cccc3ccccc23)c2c3cccc2C(c2ccccc2)(c2ccccc2)c2cccc4c2C(c2cccc5ccccc25)=C(C)C4[Zr+2]C13.[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 14)

geneUniProtsupporting neighboursconfidence
CHRNA1 known ✓ P02708 1/20 0.32
CHRNG known ✓ P07510 1/20 0.32
CHRNB1 known ✓ P11230 1/20 0.32
SLC6A2 known ✓ P23975 1/20 0.32
SLC6A3 known ✓ Q01959 1/20 0.32
CHRND known ✓ Q07001 1/20 0.32
CHRNB2 P17787 1/20 0.32
CHRNB4 P30926 1/20 0.32
SLC6A4 P31645 1/20 0.32
CHRNA3 P32297 1/20 0.32
CHRNA4 P43681 1/20 0.32
DHFR P00374 1/20 0.30
GSK3B P49841 1/20 0.30
ADK P55263 1/20 0.30

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 SCHEMBL14775250 0.80 SLC6A2 (0.34) CHRNA1CHRNGCHRNB1CHRNB2SLC6A2
Hydrochloric Acid SCHEMBL219041 0.78 HTR7 (0.34) SLC6A2SLC6A4SLC6A3DHFRGSK3B
Hydrochloric Acid SCHEMBL218908 0.78 HTR7 (0.36) SLC6A2SLC6A4SLC6A3DHFRGSK3B
Hydrochloric Acid SCHEMBL969634 0.77 DHFR (0.32) DHFRGSK3BADK
Hydrochloric Acid SCHEMBL7586032 0.77 DHFR (0.32) DHFRGSK3BADK
Hydrochloric Acid SCHEMBL7921149 0.75 ALDH1A1 (0.34)
Hydrochloric Acid SCHEMBL5616525 0.70 DHFR (0.35) CHRNA1CHRNGCHRNB1CHRNB2SLC6A2
Hydrochloric Acid SCHEMBL622158 0.69 DHFR (0.33) DHFRGSK3BADK
Hydrochloric Acid SCHEMBL7929752 0.69
Hydrochloric Acid SCHEMBL8158808 0.68 HTR1A (0.35)

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
EP-1153938-A1 CATALYST FOR STEREOREGULAR POLYMERIZATION OF ALPHA-OLEFIN AND PROCESS FOR PRODUCING STEREOREGULAR ALPHA-OLEFIN POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-11-14 EP disclosed