Hydrochloric Acid

Hydrochloric Acid

SCHEMBL8630637

CC1=Cc2ccccc2C1[Zr+2]1(C2C(C)=Cc3ccccc32)=[Si]2CC[Si]=1CC2.[Cl-].[Cl-]

nearest known ligand 0.34

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 4)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.32
CYP11B2 P19099 2/20 0.32
HTR2C P28335 2/20 0.32
CYP19A1 P11511 1/20 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 SCHEMBL9069168 0.84 ADRA2A (0.31) CYP11B1CYP11B2
Hydrochloric Acid SCHEMBL8632949 0.82 CYP11B1 (0.33) CYP11B1CYP11B2
Hydrochloric Acid SCHEMBL8635340 0.81
Hydrochloric Acid SCHEMBL8631895 0.79
Hydrochloric Acid SCHEMBL10711045 0.79 CYP11B1 (0.33) CYP11B1CYP11B2HTR2CCYP19A1
Hydrochloric Acid SCHEMBL649477 0.79 CYP11B1 (0.33) CYP11B1CYP11B2HTR2CCYP19A1
Hydrochloric Acid SCHEMBL338766 0.79 CYP11B1 (0.33) CYP11B1CYP11B2HTR2CCYP19A1
Hydrochloric Acid SCHEMBL8628713 0.76 ADRA2A (0.33)
Hydrochloric Acid SCHEMBL5351284 0.76 CYP19A1 (0.31) CYP11B1CYP11B2CYP19A1
Hydrochloric Acid SCHEMBL5516481 0.76 CYP19A1 (0.34) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5776851-A COORDINATION POLYMERIZATION CATALYST TARGOR GMBH (DE) 1998-07-07 US claimed
US-5776851-A COORDINATION POLYMERIZATION CATALYST TARGOR GMBH (DE) 1998-07-07 US disclosed
US-5693730-A METALLOCENES HAVING MORE THAN ONE CENTRAL ATOM AND A SPECIAL BRIDGE STRUCTURE FOR PREPARING ISOTACTIC, HIGH-MOLECULAR-WEIGHT POLYMERS HAVING GOOD GRAIN MORPHOLOGY; PROPYLENE HOMO- AND COPOLYMERS HOECHST AKTIENGESELLSCHAFT (DE) 1997-12-02 US disclosed
US-5585508-A POLYMERIZATION CATALYST FOR POLYOLEFINS HOECHST AG (DE) 1996-12-17 US disclosed