Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5853383

CC1=CCC([Ti+2](NC(=O)c2cccc(C(C)(C)C)c2)[SiH](C)C)=C1.[Cl-].[Cl-]

nearest known ligand 0.41

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 18)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 3/20 0.39
HDAC8 Q9BY41 4/20 0.41
HDAC6 Q9UBN7 2/20 0.41
NR1H4 Q96RI1 1/20 0.39
CTSL P07711 3/20 0.37
BRAF P15056 1/20 0.37
KCNK3 O14649 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
RXRA P19793 1/20 0.35
RXRB P28702 1/20 0.35
HDAC3 O15379 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
P2RX1 P51575 1/20 0.34
KCNK9 Q9NPC2 1/20 0.34
GAA P10253 1/20 0.34
LMNA P02545 1/20 0.34

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 SCHEMBL5853390 0.86 HDAC8 (0.46) HDAC8HDAC6KCNK3MEN1KMT2A
Hydrochloric Acid SCHEMBL5853387 0.84 SMN1; SMN2 (0.37) HDAC8HDAC6KCNK3MEN1KMT2A
Hydrochloric Acid SCHEMBL5855126 0.81 HDAC8 (0.43) HDAC8HDAC6ACHENR1H4CTSL
Hydrochloric Acid SCHEMBL5853107 0.79 THRB (0.34) SMN1; SMN2GAA
Hydrochloric Acid SCHEMBL5853198 0.78 HDAC8 (0.40) HDAC8HDAC6ACHENR1H4CTSL
Hydrochloric Acid SCHEMBL5852786 0.76
Hydrochloric Acid SCHEMBL5853300 0.76 HDAC8 (0.40) HDAC8HDAC6ACHENR1H4CTSL
Hydrochloric Acid SCHEMBL5854999 0.76 HPGD (0.38) KCNK3MEN1KMT2ASMN1; SMN2KCNK9
Hydrochloric Acid SCHEMBL5853379 0.74 KCNK3 (0.39) KCNK3KMT2AKCNK9GAALMNA
Hydrochloric Acid SCHEMBL5853728 0.73 NR1H4 (0.41) HDAC8HDAC6ACHENR1H4CTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7037989-B2 Copolymers of ethylene and/or α-olefins and vicinally disubstituted olefins EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-05-02 US disclosed
WO-2004106394-A1 COPOLYMERS OF ETHYLENE AND/OR α-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-12-09 WO disclosed
US-20040242814-A1 COPOLYMERS OF ETHYLENE AND/OR ALPHA-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. 2004-12-02 US disclosed