Hydrochloric Acid

Hydrochloric Acid

SCHEMBL1899672

Cc1ccc2c(c1)c1c(n2C)-c2ccccc2C1[Zr+2]C1=CC=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 8)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 1/20 0.30
MEN1 O00255 1/20 0.34
NR1I2 O75469 1/20 0.34
AHR P35869 1/20 0.34
KMT2A Q03164 1/20 0.34
KDM4E B2RXH2 1/20 0.33
NTRK1 P04629 1/20 0.31
BCHE P06276 1/20 0.30

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 SCHEMBL7634800 0.88 NTRK1 (0.33) NTRK1
Hydrochloric Acid SCHEMBL1899675 0.77 MEN1 (0.35) MEN1NR1I2AHRKMT2AKDM4E
Hydrochloric Acid SCHEMBL7128456 0.73 GPR3 (0.31) NTRK1
Hydrochloric Acid SCHEMBL524858 0.72 GPR3 (0.33)
Methane SCHEMBL5348855 0.71 GPR3 (0.32)
Hydrochloric Acid SCHEMBL3495487 0.71 MEN1 (0.36) MEN1NR1I2AHRKMT2AKDM4E
Hydrochloric Acid SCHEMBL6244416 0.71 KDM4E (0.37) MEN1NR1I2AHRKMT2AKDM4E
Hydrochloric Acid SCHEMBL6230243 0.70
Hydrochloric Acid SCHEMBL6230015 0.70 CHRNB2 (0.33)
Cyclopentane SCHEMBL6557619 0.70 BCHE (0.33) BCHEACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7829641-B2 Process for the preparation of multimodal polyethylene resins EQUISTAR CHEMICALS, LP (US) 2010-11-09 US claimed
US-20100016526-A1 Process for the preparation of multimodal polyethylene resins EQUISTAR CHEMICALS, LP 2010-01-21 US claimed
EP-2321369-A1 POLYETHYLENE THICK FILM AND PROCESS FOR PREPARING POLYETHYLENE Equistar Chemicals, LP (US) 2011-05-18 EP disclosed
US-7829641-B2 Process for the preparation of multimodal polyethylene resins EQUISTAR CHEMICALS, LP (US) 2010-11-09 US disclosed
US-7816478-B2 Polyethylene thick film and process for preparing polyethylene EQUISTAR CHEMICALS, LP (US) 2010-10-19 US disclosed
WO-2010027396-A1 POLYETHYLENE THICK FILM AND PROCESS FOR PREPARING POLYETHYLENE EQUISTAR CHEMICALS, LP (US) 2010-03-11 WO disclosed
US-20100055432-A1 thickness of 50 to 200 microns; Ethylene-Octene copolymer; bimodal molecular weight distribution; high impact strength; high modulus; two slurry zones with bridged and non-bridged zirconium complex catalysts; dialkylsilylene-bridged and unbridged cyclopentadienyl(indeno[2,1-b]indolyl)zirconium complex EQUISTAR CHEMICALS, LP 2010-03-04 US disclosed
US-20100016526-A1 Process for the preparation of multimodal polyethylene resins EQUISTAR CHEMICALS, LP 2010-01-21 US disclosed