Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6520728

CC1=Cc2cc(C)n(-c3ccccc3)c2C1.C[SiH](C)O[Zr+2].[Cl-].[Cl-]

nearest known ligand 0.33

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 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.33
NOTUM Q6P988 1/20 0.33
HPGD P15428 5/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
MAPT P10636 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
KDM4E B2RXH2 2/20 0.32
HTT P42858 2/20 0.32
NCOA3 Q9Y6Q9 1/20 0.32
LMNA P02545 2/20 0.31
MITF O75030 1/20 0.31
PLA2G1B P04054 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
ATG4B Q9Y4P1 1/20 0.31
POLB P06746 2/20 0.30
RAB9A P51151 1/20 0.30
MYC P01106 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
SCHEMBL6446839 0.87 ALDH1A1 (0.40) ALDH1A1NOTUMHPGDMEN1KMT2A
Hydrochloric Acid SCHEMBL6519202 0.83 ALDH1A1 (0.35) ALDH1A1NOTUMHPGDMEN1KMT2A
Hydrochloric Acid SCHEMBL6519742 0.73
SCHEMBL2964749 0.73 HPGD (0.32) ALDH1A1NOTUMHPGDMEN1KMT2A
Hydrochloric Acid SCHEMBL1071449 0.68 ALDH1A1 (0.39) ALDH1A1NOTUMHPGDMEN1KMT2A
Hydrochloric Acid SCHEMBL6516143 0.68 NOTUM (0.32) NOTUM
SCHEMBL6442563 0.67 ALDH1A1 (0.41) ALDH1A1NOTUMHPGDMEN1KMT2A
SCHEMBL5974667 0.66 ALDH1A1 (0.40) ALDH1A1NOTUMHPGDMEN1KMT2A
Hydrochloric Acid SCHEMBL6515371 0.62
SCHEMBL7096550 0.62 ALDH1A1 (0.34) ALDH1A1NOTUMMEN1KMT2AMAPT

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
US-6872843-B2 Non-metallocene compounds, method for the production thereof and use of the same for the polymerization of olefins BASELL POLYOLEFINE GMBH (DE) 2005-03-29 US disclosed
US-20040023940-A1 Non-metallocene compounds, method for the production thereof and use of the same for the polymerisation of olefins EQUISTAR CHEMICALS, LP 2004-02-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040023940-A1 Non-metallocene compounds, method for the production thereof and use of the same for the polymerisation of olefins SOAT2, NOTUM, SOAT1 ALDH1A1 1428/4885NOTUM 2/4885HPGD 886/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.