Hydrochloric Acid

Hydrochloric Acid

SCHEMBL394711

CC(C)(C)c1cccc(C(C)(C)C)c1O[Ti+2]C1=CC=CC1.[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 2)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.32
ALDH1A1 P00352 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
Bromide SCHEMBL6312692 0.97 CA2 (0.32) CA2ALDH1A1
Iodide SCHEMBL6307196 0.97 CA2 (0.32) CA2ALDH1A1
Fluoride Ion SCHEMBL6304345 0.97 CA2 (0.32) CA2ALDH1A1
Hydrochloric Acid SCHEMBL3154711 0.83 ALDH1A1 (0.34) CA2ALDH1A1
Hydrochloric Acid SCHEMBL6306871 0.83
Hydrochloric Acid SCHEMBL6304295 0.83 ALDH1A1 (0.37) ALDH1A1
Hydrochloric Acid SCHEMBL6306103 0.81 CA1 (0.40) CA2
Bromide SCHEMBL3147465 0.80 ALDH1A1 (0.34) CA2ALDH1A1
Iodide SCHEMBL6304877 0.80
Iodide SCHEMBL3156624 0.80 ALDH1A1 (0.34) CA2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6951906-B1 Process for hydrogenating a conjugated diene polymer KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 2005-10-04 US claimed
EP-1124863-B1 PROCESS FOR HYDROGENATING A CONJUGATED DIENE POLYMER KOREA KUMHO PETROCHEM CO LTD (KR) 2004-07-21 EP claimed
EP-1124863-A1 PROCESS FOR HYDROGENATING A CONJUGATED DIENE POLYMER Korea Kumho Petrochemical Co. Ltd. (KR) 2001-08-22 EP claimed
WO-2000008069-A1 PROCESS FOR HYDROGENATING A CONJUGATED DIENE POLYMER KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 2000-02-17 WO claimed
US-8431659-B2 Prepolymerized catalyst for olefin polymerization, method of producing this prepolymerized catalyst and method of producing olefin polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-04-30 US disclosed
US-20120095173-A1 PREPOLYMERIZED CATALYST FOR OLEFIN POLYMERIZATION, METHOD OF PRODUCING THIS PREPOLYMERIZED CATALYST AND METHOD OF PRODUCING OLEFIN POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-04-19 US disclosed
US-8101537-B2 Prepolymerized catalyst for olefin polymerization, method of producing this prepolymerized catalyst and method of producing olefin polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-01-24 US disclosed
US-20100280196-A1 PREPOLYMERIZED CATALYST FOR OLEFIN POLYMERIZATION, METHOD OF PRODUCING THIS PREPOLYMERIZED CATALYST AND METHOD OF PRODUCING OLEFIN POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-04 US disclosed
EP-1435362-B1 Process for polymer hydrogenation using lithium hydride prepared from reactor equipped with high-speed injection nozzle KOREA KUMHO PETROCHEM CO LTD (KR) 2010-03-03 EP disclosed
US-6951906-B1 Process for hydrogenating a conjugated diene polymer KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 2005-10-04 US disclosed
US-6864326-B2 Process for polymer hydrogenation using lithium hydride prepared from reactor equipped with high-speed injection nozzle KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 2005-03-08 US disclosed
EP-1124863-B1 PROCESS FOR HYDROGENATING A CONJUGATED DIENE POLYMER KOREA KUMHO PETROCHEM CO LTD (KR) 2004-07-21 EP disclosed
US-20040132916-A1 Process for polymer hydrogenation using lithium hydride prepared from reactor equipped with high-speed injection nozzle KOREA KUMHO PETROCHEMICAL CO., LTD. 2004-07-08 US disclosed
EP-1435362-A1 Process for polymer hydrogenation using lithium hydride prepared from reactor equipped with high-speed injection nozzle Korea Kumho Petrochemical Co. Ltd. (KR) 2004-07-07 EP disclosed
EP-1124863-A1 PROCESS FOR HYDROGENATING A CONJUGATED DIENE POLYMER Korea Kumho Petrochemical Co. Ltd. (KR) 2001-08-22 EP disclosed
WO-2000008069-A1 PROCESS FOR HYDROGENATING A CONJUGATED DIENE POLYMER KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 2000-02-17 WO disclosed