Hydrochloric Acid

Hydrochloric Acid

SCHEMBL1683335

CCCCCCCCCCCCCCCCCC[N+](C)(C)CCOCCO.[Cl-]

nearest known ligand 0.62

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 20)

geneUniProtsupporting neighboursconfidence
CHRM2 known ✓ P08172 1/20 0.46
CHRM1 known ✓ P11229 1/20 0.46
CHRM3 known ✓ P20309 1/20 0.46
SLC6A2 known ✓ P23975 1/20 0.46
SLC6A3 known ✓ Q01959 1/20 0.46
DNM1 Q05193 8/20 0.62
HTT P42858 3/20 0.57
KMT2A Q03164 2/20 0.57
MEN1 O00255 1/20 0.57
THRB P10828 1/20 0.57
MAPT P10636 1/20 0.57
TSHR P16473 1/20 0.52
HSP90AA1 P07900 2/20 0.47
RAD52 P43351 2/20 0.47
PLA2G1B P04054 1/20 0.47
ATG4B Q9Y4P1 1/20 0.47
MLNR O43193 1/20 0.46
NR1I2 O75469 1/20 0.46
ESR1 P03372 1/20 0.46
NR3C1 P04150 1/20 0.46

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 SCHEMBL1683346 1.00 DNM1 (0.62) DNM1HTTKMT2AMEN1THRB
Hydrochloric Acid SCHEMBL4805429 1.00 DNM1 (0.62) DNM1HTTKMT2AMEN1THRB
Hydrochloric Acid SCHEMBL5552101 1.00 DNM1 (0.62) DNM1HTTKMT2AMEN1THRB
SCHEMBL7091336 0.98 DNM1 (0.64) DNM1HTTKMT2AMEN1THRB
SCHEMBL7089797 0.98 DNM1 (0.64) DNM1HTTKMT2AMEN1THRB
SCHEMBL4808190 0.98 DNM1 (0.64) DNM1HTTKMT2AMEN1THRB
Hydrochloric Acid SCHEMBL7940293 0.90 HTT (0.68) DNM1HTTKMT2AHSP90AA1RAD52
Hydrochloric Acid SCHEMBL4801453 0.89 DNM1 (0.50) DNM1HTTKMT2AMEN1THRB
SCHEMBL25834238 0.89 DNM1 (0.61) DNM1HTTKMT2AMEN1THRB
SCHEMBL31347471 0.88 HTT (0.71) DNM1HTTKMT2AHSP90AA1RAD52

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
US-20110124772-A1 ANTIMICROBIAL POLYMERS AND THEIR USES DSM IP ASSETS B.V. (NL) 2011-05-26 US disclosed
EP-2309851-A2 ANTIMICROBIAL POLYMERS AND THEIR USES DSM IP Assets B.V. (NL) 2011-04-20 EP disclosed
WO-2009148880-A2 ANTIMICROBIAL POLYMERS AND THEIR USES DSM IP ASSETS B.V. (NL) 2009-12-10 WO disclosed