Hydrochloric Acid

Hydrochloric Acid

SCHEMBL28523486

CCCC[N+](CCCC)(CCCC)Cc1ccccc1.CCCC[N+](CCCC)(CCCC)Cc1ccccc1.O=S(=O)([O-])c1ccc(O)c2ccccc12.[Cl-]

nearest known ligand 0.40

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
LDHA P00338 1/20 0.40
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
TP53 P04637 1/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HTT P42858 2/20 0.36
GAA P10253 1/20 0.36
DNM1 Q05193 2/20 0.35
THRB P10828 1/20 0.35
NR4A1 P22736 1/20 0.34
COMT P21964 1/20 0.34
CYP1A2 P05177 1/20 0.34
EP300 Q09472 1/20 0.34
KDM4E B2RXH2 1/20 0.34
TNNI3 P19429 1/20 0.33
TNNT2 P45379 1/20 0.33
TNNC1 P63316 1/20 0.33
HKDC1 Q2TB90 1/20 0.33
ESR1 P03372 1/20 0.33

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
SCHEMBL14927 0.99 LDHA (0.41) LDHAMEN1KMT2ATP53MAPK1
SCHEMBL16412126 0.94 DNM1 (0.43) LDHAMEN1KMT2ATP53MAPK1
SCHEMBL16412124 0.93 LDHA (0.44) LDHAMEN1KMT2AGAATHRB
Tetrabuthylammonium SCHEMBL16412173 0.89 LDHA (0.47) LDHAMEN1KMT2AGAATHRB
SCHEMBL10383940 0.89 NR4A1 (0.46) MEN1KMT2ATP53MAPK1SMN1; SMN2
SCHEMBL446313 0.88 TNNI3 (0.44) LDHAMEN1KMT2ATP53MAPK1
SCHEMBL10382892 0.88 NR4A1 (0.40) LDHAMEN1KMT2ATP53MAPK1
SCHEMBL2533438 0.87 LDHA (0.45) LDHAMEN1KMT2AGAATHRB
SCHEMBL180944 0.85 HKDC1 (0.41) MEN1KMT2ATP53MAPK1SMN1; SMN2
SCHEMBL9503533 0.85 NSD2 (0.38) MEN1KMT2ATP53MAPK1SMN1; SMN2

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
CN-107247394-B Carbon powder for heating fixing process and preparation method thereof 湖北远东卓越科技股份有限公司 2020-12-29 CN claimed
CN-107247394-B Carbon powder for heating fixing process and preparation method thereof 湖北远东卓越科技股份有限公司 2020-12-29 CN disclosed