Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6848149

C[SiH](C)[Hf+](Nc1cccc(C(C)(C)C)c1)C1=CC=CC1.C[SiH](C)[Hf+](Nc1cccc(C(C)(C)C)c1)C1=CC=CC1.[Cl-].[Cl-]

nearest known ligand 0.33

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 12)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
KCNJ6 P48051 1/20 0.33
KCNJ5 P48544 1/20 0.33
KCNJ3 P48549 1/20 0.33
KIF11 P52732 2/20 0.32
GRM4 Q14833 1/20 0.32
RAF1 P04049 1/20 0.32
HRH3 Q9Y5N1 1/20 0.30
P2RX1 P51575 1/20 0.30
ABCG2 Q9UNQ0 1/20 0.30

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 SCHEMBL6832126 0.81
Hydrochloric Acid SCHEMBL6835299 0.72
Hydrochloric Acid SCHEMBL6698527 0.70 KMT2A (0.31)
Hydrochloric Acid SCHEMBL6848151 0.69 GRM4 (0.34) HDAC3HDAC8HDAC6KCNJ6KCNJ5
Hydrochloric Acid SCHEMBL6858910 0.69 MAPT (0.33)
Hydrochloric Acid SCHEMBL6864998 0.67 RAPGEF4 (0.33)
Hydrochloric Acid SCHEMBL6848155 0.67 HDAC3 (0.33) HDAC3HDAC8HDAC6KCNJ6KCNJ5
SCHEMBL9290330 0.63 HDAC8 (0.47) HDAC3HDAC8HDAC6KCNJ6KCNJ5
SCHEMBL21625856 0.63 KIF11 (0.54) HDAC3HDAC8HDAC6KCNJ6KCNJ5
SCHEMBL29514710 0.63 KIF11 (0.54) HDAC3HDAC8HDAC6KCNJ6KCNJ5

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-2004106394-A1 COPOLYMERS OF ETHYLENE AND/OR α-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-12-09 WO disclosed