Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5909810

COc1ccc(OC)c2c1C=CC2[Ti+2]1(C2C=Cc3c(OC)ccc(OC)c32)CC1.[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 14)

geneUniProtsupporting neighboursconfidence
PTAFR known ✓ P25105 1/20 0.30
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA4 P22748 1/20 0.34
CA7 P43166 1/20 0.34
CA9 Q16790 1/20 0.34
CA14 Q9ULX7 1/20 0.34
NR3C1 P04150 1/20 0.33
ADRA1A P35348 4/20 0.32
HTR2A P28223 3/20 0.31
HTR2C P28335 3/20 0.31
HTR2B P41595 3/20 0.31
CETP P11597 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 SCHEMBL27636305 0.72 NR3C1 (0.32) CA12CA1CA2CA4CA7
Hydrochloric Acid SCHEMBL28066485 0.72 NR3C1 (0.32) CA12CA1CA2CA4CA7
SCHEMBL17014295 0.71 NR3C1 (0.38) CA12CA1CA2CA4CA7
Hydrochloric Acid SCHEMBL29911832 0.70 NR3C1 (0.32) NR3C1ADRA1A
Hydrochloric Acid SCHEMBL7553845 0.70 NR3C1 (0.32) NR3C1ADRA1A
Hydrochloric Acid SCHEMBL6356342 0.70 ADRA1A (0.35) ADRA1AHTR2AHTR2CHTR2B
Hydrochloric Acid SCHEMBL4004708 0.70 ADRA1A (0.32) ADRA1A
SCHEMBL27282348 0.69 NR3C1 (0.33) CA12CA1CA2CA4CA7
SCHEMBL28331513 0.69 NR3C1 (0.33) CA12CA1CA2CA4CA7
Hydrochloric Acid SCHEMBL9440762 0.68 NR3C1 (0.32) CA12CA1CA2CA4CA7

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-9469701-B2 Polyethylene powder ASAHI KASEI CHEMICALS CORPORATION (JP) 2016-10-18 US disclosed
US-20160137760-A1 Polyethylene Powder ASAHI KASEI CHEMICALS CORPORATION (JP) 2016-05-19 US disclosed
US-20060287449-A1 Ultrahigh-molecular ethylene polymer ASAHI KASEI CHEMICALS CORPORATION (JP) 2006-12-21 US disclosed
EP-1605000-A1 ULTRAHIGH-MOLECULAR ETHYLENE POLYMER Asahi Kasei Chemicals Corporation (JP) 2005-12-14 EP disclosed