Hydrochloric Acid

Hydrochloric Acid

SCHEMBL2450404

CC1C2=Cc3ccccc3[C@@H]2[Zr+2][C@H]2C1=Cc1ccccc12.[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 7)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.34
DRD4 P21917 5/20 0.34
CYP19A1 P11511 1/20 0.34
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
BRD4 O60885 1/20 0.33
CCL2 P13500 1/20 0.33

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 SCHEMBL887737 1.00 DRD2 (0.34) DRD2DRD4CYP19A1CYP11B1CYP11B2
Hydrochloric Acid SCHEMBL8762469 0.80 CYP19A1 (0.37) CYP19A1CYP11B1CYP11B2
Hydrochloric Acid SCHEMBL15808748 0.78 MEN1 (0.34)
Hydrochloric Acid SCHEMBL547374 0.73
Hydrochloric Acid SCHEMBL547310 0.73 HTR2A (0.31)
Hydrochloric Acid SCHEMBL5348306 0.73 DRD2 (0.33) DRD2DRD4
Hydrochloric Acid SCHEMBL3763829 0.73
Hydrochloric Acid SCHEMBL5348571 0.73
Hydrochloric Acid SCHEMBL3821146 0.73 CYP11B1 (0.31) CYP11B1CYP11B2
Hydrochloric Acid SCHEMBL3645288 0.72 KDM1A (0.37) CYP19A1CYP11B1CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140323665-A1 Polyalphaolefins by Oligomerization and Isomerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2014-10-30 US disclosed
EP-2283050-B1 PRODUCTION OF SHEAR-STABLE HIGH VISCOSITY PAO EXXONMOBIL CHEM PATENTS INC (US) 2012-05-09 EP disclosed
EP-2247629-B1 IMPROVED UTILIZATION OF LINEAR ALPHA OLEFINS IN THE PRODUCTION OF METALLOCENE CATALYZED POLY-ALPHA OLEFINS EXXONMOBIL CHEM PATENTS INC (US) 2011-09-14 EP disclosed
EP-2247629-A1 IMPROVED UTILIZATION OF LINEAR ALPHA OLEFINS IN THE PRODUCTION OF METALLOCENE CATALYZED POLY-ALPHA OLEFINS ExxonMobil Chemical Patents Inc. (US) 2010-11-10 EP disclosed
WO-2009097069-A1 IMPROVED UTILIZATION OF LINEAR ALPHA OLEFINS IN THE PRODUCTION OF METALLOCENE CATALYZED POLY-ALPHA OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2009-08-06 WO disclosed