Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7143978

CC(C)=[Zr+2](C1=CC2=C(CCCC2)C1c1ccccc1)C1=CC2=C(CCCC2)C1c1ccccc1.[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 5)

geneUniProtsupporting neighboursconfidence
ADRA2C P18825 1/20 0.30
PTGS2 P35354 1/20 0.30
HRH1 P35367 1/20 0.30
HTR3A P46098 1/20 0.30
PDE4D Q08499 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 SCHEMBL7195631 1.00 ADRA2C (0.30) ADRA2CPTGS2HRH1HTR3APDE4D
Hydrochloric Acid SCHEMBL7136664 0.81 NOS1 (0.31)
Hydrochloric Acid SCHEMBL7138513 0.80 NOS1 (0.32)
Hydrochloric Acid SCHEMBL7142851 0.72
Hydrochloric Acid SCHEMBL7189674 0.72
Hydrochloric Acid SCHEMBL7137095 0.72
Hydrochloric Acid SCHEMBL7777847 0.71 NOS1 (0.33)
Hydrochloric Acid SCHEMBL7779196 0.71 NOS1 (0.33)
Hydrochloric Acid SCHEMBL7779191 0.71 NOS1 (0.33)
SCHEMBL7143983 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882072-B1 ANIONIC PHOTOCATALYST DSM NV (NL) 2000-11-08 EP claimed
EP-1047702-B1 BIS(TETRAHYYDRO-INDENYL) METALLOCENES AS OLEFIN-POLYMERIZATION- CATALYST BASELL POLYOLEFINE GMBH (DE) 2003-01-22 EP disclosed
EP-1047702-A1 BIS(TETRAHYYDRO-INDENYL) METALLOCENES AS OLEFIN-POLYMERIZATION- CATALYST Montell Technology Company bv (NL) 2000-11-02 EP disclosed
WO-2000029416-A1 BIS(TETRAHYDRO-INDENYL) METALLOCENES AS OLEFIN-POLYMERISATION-CATALYST MONTELL TECHNOLOGY COMPANY B.V. (NL) 2000-05-25 WO disclosed