Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7039631

CC1=CC(C)c2c1c1ccccc1c1cccc([Ti+2](C)(C)NC(=O)c3ccccc3)c21.[Cl-].[Cl-].[SiH4]

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 5)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
RAB9A P51151 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 SCHEMBL7039902 0.83 GAA (0.35) SMN1; SMN2LMNAPOLBRAB9A
Hydrochloric Acid SCHEMBL7174111 0.80
Hydrochloric Acid SCHEMBL7041823 0.72 SMN1; SMN2 (0.32) SMN1; SMN2LMNARAB9A
Hydrochloric Acid SCHEMBL7243552 0.71 SMN1; SMN2 (0.33) ADORA3SMN1; SMN2LMNAPOLBRAB9A
Hydrochloric Acid SCHEMBL7247941 0.66 RAB9A (0.32) ADORA3SMN1; SMN2LMNAPOLBRAB9A
SCHEMBL8022750 0.64
Hydrochloric Acid SCHEMBL7040765 0.63 SMN1; SMN2 (0.33) SMN1; SMN2LMNARAB9A
Hydrochloric Acid SCHEMBL7041468 0.63 SMN1; SMN2 (0.33) SMN1; SMN2LMNARAB9A
Hydrochloric Acid SCHEMBL3821780 0.62 NPC1 (0.36) SMN1; SMN2LMNAPOLBRAB9A
SCHEMBL17192654 0.53 HDAC3 (0.48) SMN1; SMN2LMNAPOLBRAB9A

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
EP-1017701-B1 CYCLOPENTAPHENANTHRENYL TITANIUM COMPLEXES AND POLYMERIZATION PROCESS DOW GLOBAL TECHNOLOGIES INC (US) 2003-03-19 EP claimed
US-6323294-B1 CONTACTING C.SUB.2-100,000 OLEFIN/S UNDER POLYMERIZATION CONDITIONS WITH CATALYST SYSTEM COMPRISING METAL COMPLEX AND ACTIVATING COCATALYST OR REACTION PRODUCT OF METAL COMPLEX AND COCATALYST TO FORM ADDITION POLYMER THE DOW CHEMICAL COMPANY 2001-11-27 US claimed
EP-1017701-B1 CYCLOPENTAPHENANTHRENYL TITANIUM COMPLEXES AND POLYMERIZATION PROCESS DOW GLOBAL TECHNOLOGIES INC (US) 2003-03-19 EP disclosed
US-6323294-B1 CONTACTING C.SUB.2-100,000 OLEFIN/S UNDER POLYMERIZATION CONDITIONS WITH CATALYST SYSTEM COMPRISING METAL COMPLEX AND ACTIVATING COCATALYST OR REACTION PRODUCT OF METAL COMPLEX AND COCATALYST TO FORM ADDITION POLYMER THE DOW CHEMICAL COMPANY 2001-11-27 US disclosed
US-6150297-A Cyclopentaphenanthrenyl metal complexes and polymerization process THE DOW CHEMICAL COMPANY (US) 2000-11-21 US disclosed