Hydrochloric Acid

Hydrochloric Acid

SCHEMBL2148025

[Cl-].[Cl-].[Cl-].[Cl-].[Zr+4].c1ccc(-c2nc3ccccc3[nH]2)cc1

nearest known ligand 0.92

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
NPC1 O15118 9/20 0.92
RAB9A P51151 9/20 0.92
GAA P10253 2/20 0.92
KDM4E B2RXH2 12/20 0.76
ALDH1A1 P00352 11/20 0.76
PKN1 Q16512 1/20 0.76
PKN2 Q16513 1/20 0.76
SMN1; SMN2 Q16637 9/20 0.69
HSD17B10 Q99714 6/20 0.69
TP53 P04637 4/20 0.69
PKM P14618 3/20 0.69
ABCB11 O95342 1/20 0.69
NPSR1 Q6W5P4 1/20 0.69
LDHA P00338 1/20 0.69
EPHX2 P34913 1/20 0.69
HPGD P15428 9/20 0.68
MAPT P10636 4/20 0.68
GFER P55789 2/20 0.68
POLB P06746 1/20 0.68
KMT2A Q03164 2/20 0.63

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 SCHEMBL2147086 0.96 NPC1 (0.92) NPC1RAB9AGAAKDM4EALDH1A1
SCHEMBL105095 0.96 NPC1 (1.00) NPC1RAB9AGAAKDM4EALDH1A1
Benzene SCHEMBL28005151 0.96 NPC1 (1.00) NPC1RAB9AGAAKDM4EALDH1A1
Hydrogen Sulfide SCHEMBL28075074 0.94 NPC1 (0.96) NPC1RAB9AGAAKDM4EALDH1A1
SCHEMBL4775610 0.94 NPC1 (0.96) NPC1RAB9AGAAKDM4EALDH1A1
SCHEMBL27926515 0.94 NPC1 (0.96) NPC1RAB9AGAAKDM4EALDH1A1
SCHEMBL2147022 0.94 NPC1 (0.96) NPC1RAB9AGAAKDM4EALDH1A1
SCHEMBL467859 0.94 NPC1 (0.96) NPC1RAB9AGAAKDM4EALDH1A1
Potassium SCHEMBL4891434 0.94 NPC1 (0.96) NPC1RAB9AGAAKDM4EALDH1A1
SCHEMBL16416275 0.94 NPC1 (0.96) NPC1RAB9AGAAKDM4EALDH1A1

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
WO-2011088990-A1 ETHYLENE POLYMERISATION SAUDI BASIC INDUSTRIES CORPORATION (SABIC) (SA) 2011-07-28 WO disclosed