Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6904476

C=[Ti+2](C1C(c2ccccc2)=Cc2ccccc21)C1C(c2ccccc2)=Cc2ccccc21.[Cl-].[Cl-]

nearest known ligand 0.32

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 3)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.32
CYP11B2 P19099 2/20 0.32
CYP19A1 P11511 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 SCHEMBL714587 0.78 CYP11B1 (0.33) CYP11B1CYP11B2CYP19A1
Hydrochloric Acid SCHEMBL968804 0.78 CYP11B1 (0.33) CYP11B1CYP11B2CYP19A1
Hydrochloric Acid SCHEMBL392658 0.78 CYP11B1 (0.33) CYP11B1CYP11B2CYP19A1
Hydrochloric Acid SCHEMBL29790383 0.78 CYP11B1 (0.33) CYP11B1CYP11B2CYP19A1
SCHEMBL27448383 0.75 ALDH1A1 (0.33) CYP11B1CYP11B2CYP19A1
Hydrochloric Acid SCHEMBL5872672 0.74 CYP19A1 (0.30) CYP11B1CYP11B2CYP19A1
Hydrochloric Acid SCHEMBL7940146 0.73 ALDH1A1 (0.32) CYP11B1CYP11B2CYP19A1
Hydrochloric Acid SCHEMBL1539598 0.73 CYP11B1 (0.35) CYP11B1CYP11B2CYP19A1
Hydrochloric Acid SCHEMBL1681583 0.72 CYP11B1 (0.34) CYP11B1CYP11B2CYP19A1
SCHEMBL8673364 0.72 ALDH1A1 (0.36) CYP11B1CYP11B2CYP19A1

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-6790917-B2 POLYMERIZING A VINYL COMPOUND IN PRESENCE OF A CATALYST OBTAINED BY COMBINING ORGANOTRANSITION METAL COMPOUND, AN ALUMINUM COMPUND OR ALUMOXANE AND A BORON COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-09-14 US disclosed
US-20020198340-A1 Process for producing vinyl compound polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-12-26 US disclosed