Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5854022

CC1=C(C)C(C)C([Hf+2](NC(=O)c2ccccc2C(C)C)[SiH](c2ccccc2)c2ccccc2)=C1C.[Cl-].[Cl-]

nearest known ligand 0.37

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 17)

geneUniProtsupporting neighboursconfidence
KCNK3 O14649 3/20 0.34
KCNK9 Q9NPC2 3/20 0.34
LMNA P02545 3/20 0.33
KMT2A Q03164 2/20 0.33
BCL2 P10415 1/20 0.32
ALDH1A1 P00352 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C19 P33261 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
GAA P10253 1/20 0.31
HTT P42858 1/20 0.31
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
ITGB1 P05556 1/20 0.30
ITGA4 P13612 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 SCHEMBL5852677 0.90 LMNA (0.34) LMNAKMT2AITGB1ITGA4
Hydrochloric Acid SCHEMBL5854332 0.87 KCNK3 (0.36) KCNK3KCNK9LMNAKMT2ABCL2
Hydrochloric Acid SCHEMBL5853525 0.87 HPGD (0.40) KCNK3KCNK9GAA
Hydrochloric Acid SCHEMBL5853885 0.85 ITGB1 (0.35) LMNAGAAITGB1ITGA4
Hydrochloric Acid SCHEMBL5853650 0.83 SMN1; SMN2 (0.33) LMNAKMT2AALDH1A1CYP3A4CYP2C19
Hydrochloric Acid SCHEMBL5855617 0.81 NAPRT (0.30)
Hydrochloric Acid SCHEMBL6850659 0.81 POLB (0.32)
Hydrochloric Acid SCHEMBL5854993 0.81 L3MBTL1 (0.34) TDP1ITGB1ITGA4
Hydrochloric Acid SCHEMBL5854430 0.80 POLB (0.36) KCNK3KCNK9KMT2AGAAMEN1
Hydrochloric Acid SCHEMBL5855109 0.79 GAA (0.33) KMT2AALDH1A1GAAMEN1MAPT

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 2 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
US-20040242814-A1 COPOLYMERS OF ETHYLENE AND/OR ALPHA-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. 2004-12-02 US disclosed