Hydrochloric Acid

Hydrochloric Acid

SCHEMBL28501552

CCCCCCCCCCCCCCCCC[n+]1cc[nH]c1.[Cl-]

nearest known ligand 0.53

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 2/20 0.50
CHRM1 known ✓ P11229 2/20 0.50
ACHE known ✓ P22303 2/20 0.50
SLC6A2 known ✓ P23975 2/20 0.50
SLC6A3 known ✓ Q01959 2/20 0.50
CHRM3 known ✓ P20309 1/20 0.48
KMT2A Q03164 3/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
MEN1 O00255 2/20 0.53
MAPT P10636 2/20 0.53
MAPK1 P28482 1/20 0.53
CASP2 P42575 1/20 0.53
RAD52 P43351 3/20 0.52
HSPD1 P10809 1/20 0.52
HSPE1 P61604 1/20 0.52
ADRA2A P08913 2/20 0.50
ADORA3 P0DMS8 2/20 0.50
SLC6A4 P31645 2/20 0.50
ABCB11 O95342 1/20 0.50
ESR1 P03372 1/20 0.50

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 SCHEMBL27221210 1.00 KMT2A (0.53) KMT2ASMN1; SMN2MEN1MAPTMAPK1
Hydrochloric Acid SCHEMBL28084888 1.00 KMT2A (0.53) KMT2ASMN1; SMN2MEN1MAPTMAPK1
Hydrochloric Acid SCHEMBL27221209 1.00 KMT2A (0.53) KMT2ASMN1; SMN2MEN1MAPTMAPK1
Hydrochloric Acid SCHEMBL5616273 1.00 KMT2A (0.53) KMT2ASMN1; SMN2MEN1MAPTMAPK1
Hydrochloric Acid SCHEMBL4361600 1.00 KMT2A (0.53) KMT2ASMN1; SMN2MEN1MAPTMAPK1
Hydrochloric Acid SCHEMBL25330776 1.00 KMT2A (0.53) KMT2ASMN1; SMN2MEN1MAPTMAPK1
Hydrochloric Acid SCHEMBL22026910 1.00 KMT2A (0.53) KMT2ASMN1; SMN2MEN1MAPTMAPK1
Hydrochloric Acid SCHEMBL22027281 1.00 KMT2A (0.53) KMT2ASMN1; SMN2MEN1MAPTMAPK1
Hydrochloric Acid SCHEMBL22026959 1.00 KMT2A (0.53) KMT2ASMN1; SMN2MEN1MAPTMAPK1
SCHEMBL5301397 0.98 CHRM2 (0.52) KMT2ASMN1; SMN2MEN1MAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107413386-B Catalyst for synthesizing methylal by methanol liquid-phase one-step oxidation, and preparation method and use method thereof 中国科学院成都有机化学有限公司 2020-11-24 CN disclosed