Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7932341

CN1CCNCC(Oc2ccccc2)N([Ti+2])CC1.[Cl-].[Cl-]

nearest known ligand 0.36

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 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 known ✓ P23975 2/20 0.33
SLC6A3 known ✓ Q01959 2/20 0.33
CHRM1 known ✓ P11229 1/20 0.32
HRH1 P35367 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
LTA4H P09960 1/20 0.33
HTR2C P28335 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MC4R P32245 1/20 0.33
SLC9A3 P48764 1/20 0.32
HTR2B P41595 1/20 0.32
CARM1 Q86X55 1/20 0.32
PRMT6 Q96LA8 1/20 0.32
HTR1A P08908 1/20 0.32
SLC6A4 P31645 1/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
HRH4 Q9H3N8 1/20 0.32

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 SCHEMBL7938265 0.76
Hydrochloric Acid SCHEMBL7934553 0.76
Hydrochloric Acid SCHEMBL7925633 0.76 CHRNB2 (0.41) SMN1; SMN2SLC6A2SLC6A3HTR2CMC4R
Hydrochloric Acid SCHEMBL7925604 0.76 CHRNB2 (0.41) SMN1; SMN2SLC6A2SLC6A3HTR2CMC4R
Hydrochloric Acid SCHEMBL7934542 0.75 HRH1 (0.43) HRH1SMN1; SMN2SLC6A2SLC6A3HTR2C
SCHEMBL21599177 0.73 HRH1 (0.49) HRH1SMN1; SMN2SLC6A2SLC6A3CARM1
Hydrochloric Acid SCHEMBL7932246 0.71 HRH1 (0.44) HRH1SLC6A2SLC6A3LTA4HHTR2C
SCHEMBL27889106 0.71 HRH1 (0.40) HRH1SLC6A2SLC6A3LTA4HHTR2C
SCHEMBL15974677 0.71 SLC6A2 (0.51) HRH1SLC6A2SLC6A3LTA4HHTR2C
SCHEMBL2214066 0.69 HTR2C (0.42) HRH1SLC6A2SLC6A3LTA4HHTR2C

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-6169152-B1 COPOLYMER OF ETHYLENE AND A POLAR GROUP-CONTAINING CYCLIC OLEFIN COMPRISING ESTER- OR ANHYDRIDE MODIFIED NORBORNENE OR PERHYDRO-2,3-DIDEHYDRO-1,4:5,8-DIMETHANONAPHTHALENE MADE WITH CATALYST SUCH AS 1,5,9-TRIAZACYCLODODECANYLTITANIUM CHLORIDE JSR CORPORATION (JP) 2001-01-02 US disclosed
EP-0816387-A1 Olefin-polymerizing catalyst JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1998-01-07 EP disclosed