Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7753199

C[Zr+2](C)(NC(=O)C1CCCCC1)C1c2ccccc2-c2ccccc21.[Cl-].[Cl-].[SiH4]

nearest known ligand 0.45

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 16)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 1/20 0.38
CYP2C19 P33261 1/20 0.45
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
P2RX7 Q99572 2/20 0.41
HDAC1 Q13547 2/20 0.40
HDAC2 Q92769 2/20 0.40
CETP P11597 1/20 0.40
HDAC3 O15379 1/20 0.40
KMT2A Q03164 1/20 0.39
LMNA P02545 1/20 0.38
BCHE P06276 1/20 0.38
CCKAR P32238 1/20 0.38
CCKBR P32239 1/20 0.38

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 SCHEMBL7752408 0.73 CYP2C19 (0.45) CYP2C19ALDH1A1KDM4EHPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL7753150 0.73 CYP2C19 (0.45) CYP2C19ALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL17866226 0.70 CYP2C19 (0.45) CYP2C19ALDH1A1KDM4EHPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL2033382 0.69 CYP2C19 (0.44) CYP2C19ALDH1A1KDM4EHPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL2035441 0.69 CYP2C19 (0.46) CYP2C19ALDH1A1KDM4EHPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL5854775 0.68 CYP2C19 (0.43) CYP2C19ALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL2033385 0.68 CYP2C19 (0.43) CYP2C19ALDH1A1KDM4EHPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL2040601 0.68 CYP2C19 (0.43) CYP2C19ALDH1A1KDM4EHPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL5853853 0.68 CYP2C19 (0.43) CYP2C19ALDH1A1KDM4EHPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL5854814 0.68 CYP2C19 (0.43) CYP2C19ALDH1A1KDM4EHPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0727443-B1 Catalyst for olefin polymerization and process for producing olefin polymers TOSOH CORP (JP) 2001-01-17 EP disclosed
US-5807938-A Catalyst for olefin polymerization and process for producing olefin polymers TOSOH CORPORATION (JP) 1998-09-15 US disclosed
EP-0730003-B1 Polypropylene resin composition and molded product TOSOH CORP (JP) 1997-12-29 EP disclosed
US-5608008-A ETHYLENE-A-OLEFIN COPOLYMER ELASTOMER TOSOH CORPORATION (JP) 1997-03-04 US disclosed
EP-0730003-A1 Polypropylene resin composition and molded product Tosoh Corporation (JP) 1996-09-04 EP disclosed
EP-0727443-A1 Catalyst for olefin polymerization and process for producing olefin polymers Tosoh Corporation (JP) 1996-08-21 EP disclosed