Hydrochloric Acid

Hydrochloric Acid

SCHEMBL11530944

Cc1nc2cc(C(C)C)ccc2n1C.[Cl-].[H+]

nearest known ligand 0.56

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
NAMPT known ✓ P43490 1/20 0.40
MAPT P10636 3/20 0.49
KDM4E B2RXH2 4/20 0.49
ALDH1A1 P00352 3/20 0.49
LMNA P02545 1/20 0.49
RAB9A P51151 9/20 0.44
NPC1 O15118 8/20 0.44
HDAC1 Q13547 2/20 0.44
HDAC6 Q9UBN7 2/20 0.44
HDAC3 O15379 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
HTT P42858 1/20 0.41
TP53 P04637 1/20 0.41
HSD17B10 Q99714 1/20 0.41
POLB P06746 1/20 0.41
CYP1A2 P05177 1/20 0.40

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
SCHEMBL9886621 0.97 KDM4E (0.51) MAPTKDM4EALDH1A1LMNARAB9A
Hydrochloric Acid SCHEMBL11530947 0.95 KDM4E (0.50) MAPTKDM4EALDH1A1LMNARAB9A
SCHEMBL13677547 0.83 LMNA (0.51) MAPTKDM4EALDH1A1LMNARAB9A
SCHEMBL11535686 0.79 SMN1; SMN2 (0.46) KDM4EALDH1A1LMNARAB9ANPC1
SCHEMBL12269122 0.79 HDAC6 (0.43) MAPTKDM4EALDH1A1LMNARAB9A
SCHEMBL23479165 0.78 NPC1 (0.46) MAPTKDM4EALDH1A1LMNARAB9A
SCHEMBL14288354 0.78 HDAC6 (0.45) MAPTKDM4EALDH1A1LMNARAB9A
SCHEMBL11527429 0.76 KMT2A (0.48) MAPTKDM4ELMNASMN1; SMN2KMT2A
SCHEMBL11534871 0.75 KDM4E (0.60) MAPTKDM4ELMNARAB9ANPC1
SCHEMBL18405588 0.75 ACSS2 (0.40) MAPTKDM4EALDH1A1RAB9ANPC1

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
US-4142886-A Substituted benzimidazole compounds and use as herbicides UNITED STATES BORAX & CHEMICAL CORPORATION (US) 1979-03-06 US disclosed