Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7040765

CC1C=Cc2c1c1c([Ti+2](C)(C)NC(=O)C3CCCCCCCCCCC3)cccc1c1ccccc21.[Cl-].[Cl-].[SiH4]

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 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.33
HPGD P15428 2/20 0.33
P2RX7 Q99572 2/20 0.32
GAA P10253 1/20 0.31
ALDH1A1 P00352 4/20 0.31
TSHR P16473 3/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 2/20 0.31
LMNA P02545 2/20 0.31
MAPT P10636 2/20 0.31
USP2 O75604 1/20 0.31
MEN1 O00255 1/20 0.31
CETP P11597 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HTT P42858 2/20 0.30
KDM4E B2RXH2 1/20 0.30
ALOX12 P18054 1/20 0.30
KCNK3 O14649 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 SCHEMBL7041468 1.00 SMN1; SMN2 (0.33) SMN1; SMN2HPGDP2RX7GAAALDH1A1
Hydrochloric Acid SCHEMBL7037371 0.82 TSHR (0.35) SMN1; SMN2HPGDP2RX7GAAALDH1A1
Hydrochloric Acid SCHEMBL7039656 0.82 TSHR (0.35) SMN1; SMN2HPGDP2RX7GAAALDH1A1
Hydrochloric Acid SCHEMBL7041974 0.82 GAA (0.35) SMN1; SMN2HPGDP2RX7GAAALDH1A1
Hydrochloric Acid SCHEMBL7039902 0.82 GAA (0.35) SMN1; SMN2HPGDP2RX7GAAALDH1A1
Hydrochloric Acid SCHEMBL7166895 0.78
Hydrochloric Acid SCHEMBL7238543 0.73 SMN1; SMN2 (0.37) SMN1; SMN2HPGDP2RX7GAAALDH1A1
Hydrochloric Acid SCHEMBL7239359 0.73 SMN1; SMN2 (0.37) SMN1; SMN2HPGDP2RX7GAAALDH1A1
Hydrochloric Acid SCHEMBL7246995 0.70 SMN1; SMN2 (0.38) SMN1; SMN2HPGDP2RX7GAAALDH1A1
Hydrochloric Acid SCHEMBL7241242 0.70 SMN1; SMN2 (0.38) SMN1; SMN2HPGDP2RX7GAAALDH1A1

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