Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5856669

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

nearest known ligand 0.38

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
HPGD P15428 4/20 0.38
TYK2 P29597 1/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
NPC1 O15118 4/20 0.38
RAB9A P51151 4/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
KCNK3 O14649 1/20 0.36
KCNK9 Q9NPC2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPK1 P28482 1/20 0.36
POLB P06746 1/20 0.35
FFAR1 O14842 1/20 0.35

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 SCHEMBL5853778 0.87 ALDH2 (0.32) TYK2L3MBTL1
Hydrochloric Acid SCHEMBL5854580 0.87 KCNK3 (0.38) KCNK3KCNK9ALDH1A1
Hydrochloric Acid SCHEMBL5856109 0.87 HPGD (0.39) HPGDTYK2SMN1; SMN2NPC1RAB9A
Hydrochloric Acid SCHEMBL5853743 0.86 ITGB1 (0.33)
Hydrochloric Acid SCHEMBL5854370 0.86 SMN1; SMN2 (0.37) HPGDSMN1; SMN2NPC1RAB9AKCNK3
Hydrochloric Acid SCHEMBL5855854 0.80 HDAC8 (0.46) SMN1; SMN2NPC1RAB9AKCNK3KCNK9
Hydrochloric Acid SCHEMBL5854091 0.79 LMNA (0.33) SMN1; SMN2KCNK3KCNK9
Hydrochloric Acid SCHEMBL5856054 0.78 TAS1R3 (0.36) ALDH1A1POLB
Hydrochloric Acid SCHEMBL5852944 0.77
Hydrochloric Acid SCHEMBL5854321 0.76 L3MBTL1 (0.34) L3MBTL1

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