Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7142200

C1=C([Zr+2]2(C3=CC4=C(CCCC4)[C@H]3c3ccccc3)CC2)[C@@H](c2ccccc2)C2=C1CCCC2.[Cl-].[Cl-]

nearest known ligand 0.41

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
NOS1 P29475 2/20 0.31
NOS2 P35228 2/20 0.31
KDM1A O60341 6/20 0.31
MAOA P21397 6/20 0.31
MAOB P27338 6/20 0.31

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 SCHEMBL7779191 0.74 NOS1 (0.33) NOS1NOS2
Hydrochloric Acid SCHEMBL7777847 0.74 NOS1 (0.33) NOS1NOS2
Hydrochloric Acid SCHEMBL7142441 0.71
Hydrochloric Acid SCHEMBL7195631 0.69 ADRA2C (0.30)
Hydrochloric Acid SCHEMBL7143978 0.69 ADRA2C (0.30)
Hydrochloric Acid SCHEMBL7141923 0.68
SCHEMBL7143983 0.65
SCHEMBL23118546 0.64 NOS1 (0.37) NOS1NOS2KDM1AMAOAMAOB
Hydrochloric Acid SCHEMBL27479729 0.58 CFTR (0.30)
SCHEMBL2231743 0.57 ADRA2C (0.59) NOS1NOS2

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
US-6541584-B1 Homo or copolymerizing one or more olefinic monomer in presence of a bis/tetrahydroindenyl/ metallocene catalyst BASELL POLIOLEFINE ITALIA S.P.A. (IT) 2003-04-01 US disclosed
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