Hydrochloric Acid

Hydrochloric Acid

SCHEMBL29079661

CCCCCCCCCCCCCCCC=CCN(C)C(=O)c1ccccc1-c1c2ccc(=[N+](CC)CC)cc-2oc2cc(N(CC)CC)ccc12.[Cl-]

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 18)

geneUniProtsupporting neighboursconfidence
▸ CHRM1 known ✓ P11229 2/20 0.44
▸ MEN1 O00255 2/20 0.49
▸ BLM P54132 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ USP2 O75604 1/20 0.49
▸ POLB P06746 1/20 0.49
▸ PPARG P37231 1/20 0.49
▸ RXFP1 Q9HBX9 1/20 0.49
▸ NCOR2 Q9Y618 1/20 0.49
▸ TGM2 P21980 1/20 0.48
▸ FPR2 P25090 4/20 0.47
▸ TLR7 Q9NYK1 1/20 0.44
▸ AVPR2 P30518 3/20 0.40
▸ NPY4R P50391 3/20 0.40
▸ THRB P10828 1/20 0.37
▸ RECQL P46063 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ MMP2 P08253 1/20 0.37

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 SCHEMBL29079668 0.95 MEN1 (0.49) MEN1BLMKMT2AUSP2POLB
SCHEMBL14078001 0.84 MEN1 (0.56) MEN1BLMKMT2AUSP2POLB
SCHEMBL14078000 0.83 MEN1 (0.54) MEN1BLMKMT2AUSP2POLB
Hydrochloric Acid SCHEMBL29557664 0.82 USP2 (0.53) MEN1BLMKMT2AUSP2POLB
SCHEMBL10098708 0.82 MEN1 (0.54) MEN1BLMKMT2AUSP2POLB
SCHEMBL12019154 0.81 MEN1 (0.52) MEN1BLMKMT2AUSP2POLB
Hydrochloric Acid SCHEMBL29354092 0.81 MEN1 (0.60) MEN1BLMKMT2AUSP2POLB
Hydrochloric Acid SCHEMBL30207638 0.81 MEN1 (0.60) MEN1BLMKMT2AUSP2POLB
SCHEMBL18350813 0.81 USP2 (0.53) MEN1BLMKMT2AUSP2POLB
SCHEMBL13428258 0.81 USP2 (0.53) MEN1BLMKMT2AUSP2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4267680-A1 FLUORESCENT DYES Exopharm Limited (AU) 2023-11-01 — — EP disclosed
CN-116648237-A Fluorescent dye 埃克波菲尔有限公司 2023-08-25 — — CN disclosed
WO-2022133552-A1 FLUORESCENT DYES Exopharm Limited (AU) 2022-06-30 — — WO disclosed
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