Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5550550

COc1ccc(Nc2nc(NC3CCCCCC3)nc(N(C)C3CCN(C)CC3)n2)cc1F.[Cl-].[H+]

nearest known ligand 0.49

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
EHMT2 Q96KQ7 7/20 0.49
EHMT1 Q9H9B1 6/20 0.49
BCL6 P41182 2/20 0.47
IDH2 P48735 1/20 0.45
GALR1 P47211 4/20 0.43
GALR2 O43603 3/20 0.43
CTSL P07711 1/20 0.41
CTSS P25774 1/20 0.41
CTSK P43235 1/20 0.41
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
AURKA O14965 1/20 0.39
AURKB Q96GD4 1/20 0.39

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 SCHEMBL5432850 0.99 EHMT2 (0.48) EHMT2EHMT1BCL6IDH2GALR1
SCHEMBL4829436 0.98 EHMT2 (0.50) EHMT2EHMT1BCL6IDH2GALR1
Bromide SCHEMBL6016985 0.97 EHMT2 (0.49) EHMT2EHMT1BCL6IDH2GALR1
Hydrochloric Acid SCHEMBL5550552 0.97 EHMT2 (0.49) EHMT2EHMT1BCL6IDH2GALR1
SCHEMBL6856715 0.95 EHMT2 (0.54) EHMT2EHMT1BCL6IDH2GALR1
SCHEMBL4839206 0.94 BCL6 (0.50) EHMT2EHMT1BCL6IDH2GALR1
Malonic Acid SCHEMBL4829481 0.92 EHMT2 (0.45) EHMT2EHMT1BCL6IDH2GALR1
Succinic Acid SCHEMBL4835600 0.91 EHMT2 (0.44) EHMT2EHMT1BCL6IDH2GALR1
Maleic Acid SCHEMBL4835112 0.91 EHMT2 (0.44) EHMT2EHMT1BCL6IDH2GALR1
Fumaric Acid SCHEMBL4836755 0.91 EHMT2 (0.44) EHMT2EHMT1BCL6IDH2GALR1

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-7169784-B2 Medical devices employing triazine compounds and compositions thereof REDDY US THERAPEUTICS, INC. (US) 2007-01-30 US disclosed
US-20050137196-A1 Medical devices employing triazine compounds and compositions thereof NATIONAL BANK OF CANADA (CA) 2005-06-23 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-20050137196-A1 Medical devices employing triazine compounds and compositions thereof PTGIS, AREG, TGFB1 EHMT2 2474/4885EHMT1 2630/4885BCL6 2670/4885

“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.