Hydrochloric Acid

Hydrochloric Acid

SCHEMBL813869

Cc1cc(C(C)C)c(NCCNCCNc2c(C(C)C)cc(C)cc2C(C)C)c(C(C)C)c1.[Cl-].[Cl-].[Cu+2]

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 17)

geneUniProtsupporting neighboursconfidence
CHRM1 known ✓ P11229 1/20 0.31
SLC6A2 known ✓ P23975 1/20 0.31
CARM1 Q86X55 1/20 0.33
MAPT P10636 3/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
HTT P42858 1/20 0.31
TRPA1 O75762 1/20 0.31
LMNA P02545 1/20 0.31
ADRA1A P35348 1/20 0.31
HTR2B P41595 1/20 0.31
ALDH1A1 P00352 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 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 SCHEMBL813768 0.98 CARM1 (0.32) CARM1
Hydrochloric Acid SCHEMBL814078 0.98 CARM1 (0.32) CARM1
Hydrochloric Acid SCHEMBL813489 0.98 CARM1 (0.32) CARM1
Hydrochloric Acid SCHEMBL813911 0.98 CARM1 (0.32) CARM1
SCHEMBL814388 0.96 CARM1 (0.33) CARM1MAPTCYP1A2CYP3A4CYP2D6
SCHEMBL814374 0.96 CARM1 (0.33) CARM1MAPTCYP1A2CYP3A4CYP2D6
SCHEMBL812674 0.96 CARM1 (0.33) CARM1MAPTCYP1A2CYP3A4CYP2D6
SCHEMBL814871 0.96 CARM1 (0.33) CARM1MAPTCYP1A2CYP3A4CYP2D6
Bromide SCHEMBL813226 0.94 CARM1 (0.32) CARM1
Hydrochloric Acid SCHEMBL812454 0.92 RAPGEF4 (0.35) CARM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8058372-B2 Catalyst composition II EXXONMOBIL CHEMICAL PATENTS INC. (US) 2011-11-15 US disclosed
US-20080319147-A1 Catalyst Composition II EXXONMOBIL CHEMICAL PATENTS INC. 2008-12-25 US disclosed
US-7371803-B2 Catalyst composition II EXXONMOBIL CHEMICAL PATENTS INC. (US) 2008-05-13 US disclosed
US-20070066776-A1 Catalyst composition II SOLAN GREGORY A 2007-03-22 US disclosed
US-7189791-B2 Catalyst composition II EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-03-13 US disclosed
US-20040266961-A1 Catalyst composition II EXXONMOBIL CHEMICAL PATENTS INC. 2004-12-30 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-20040266961-A1 Catalyst composition II MLX, CBX2, BMX CHRM1 372/4885SLC6A2 2736/4885CARM1 2036/4885

“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.