Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3849255

Cc1n(CC(=O)N2CCCC2)cc[n+]1C.O=C(CCl)N1CCCC1.[Cl-]

nearest known ligand 0.39

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 16)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 2/20 0.35
ALDH1A1 P00352 7/20 0.39
LMNA P02545 3/20 0.39
KDM4E B2RXH2 3/20 0.39
GAA P10253 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
HTT P42858 2/20 0.37
POLB P06746 1/20 0.37
GRIN2B Q13224 3/20 0.37
GFER P55789 1/20 0.36
YAP1 P46937 1/20 0.36
TEAD4 Q15561 1/20 0.36
TSHR P16473 1/20 0.36
MAPT P10636 3/20 0.35
TP53 P04637 1/20 0.35

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 SCHEMBL3845139 0.93 ALDH1A1 (0.43) ALDH1A1LMNAKDM4EGAAL3MBTL1
Hydrochloric Acid SCHEMBL3850494 0.92 ALDH1A1 (0.45) ALDH1A1LMNAKDM4EGAAL3MBTL1
Bromide SCHEMBL15258667 0.90 ALDH1A1 (0.43) ALDH1A1LMNAKDM4EGAAL3MBTL1
Hydrochloric Acid SCHEMBL4114930 0.81 NPC1 (0.43) ALDH1A1LMNAKDM4EGAASMN1; SMN2
Hydrochloric Acid SCHEMBL3847306 0.81 HPGD (0.37) ALDH1A1LMNAKDM4EGAAL3MBTL1
Hydrochloric Acid SCHEMBL3847607 0.81 L3MBTL3 (0.44) ALDH1A1KDM4EGAAL3MBTL1POLB
Hydrochloric Acid SCHEMBL3844455 0.80 KDM4E (0.44) ALDH1A1KDM4EGAAL3MBTL1POLB
Hydrochloric Acid SCHEMBL3845763 0.77 MAPT (0.57) ALDH1A1LMNAKDM4EGAAL3MBTL1
Hydrochloric Acid SCHEMBL3849505 0.77 SMN1; SMN2 (0.53) ALDH1A1LMNAKDM4EGAASMN1; SMN2
Hydrochloric Acid SCHEMBL3843819 0.76 DPP4 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2085086-A2 Method for treating congestive heart failure or diabetic nephropathy Synvista Therapeutics, Inc. (US) 2009-08-05 EP disclosed
EP-1305024-A4 METHOD FOR TREATING FIBROTIC DISEASES OR OTHER INDICATIONS IC ALTEON INC (US) 2006-03-22 EP disclosed
EP-1305024-A1 METHOD FOR TREATING FIBROTIC DISEASES OR OTHER INDICATIONS IC Alteon, Inc. (US) 2003-05-02 EP disclosed
WO-2002007725-A1 METHOD FOR TREATING FIBROTIC DISEASES OR OTHER INDICATIONS IC ALTEON, INC. (US) 2002-01-31 WO disclosed