Bicarbonate

Bicarbonate

SCHEMBL2959436

CC1(C2CCC3OC3C2)CCC2OC2C1.O=C(O)O

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GSK3AGSK3BIMPA1

The experimentally established mechanism targets of Bicarbonate. 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
LMNA P02545 3/20 0.38
MAPK1 P28482 2/20 0.38
TP53 P04637 2/20 0.38
NFKB1 P19838 2/20 0.38
THPO P40225 2/20 0.38
GMNN O75496 2/20 0.38
PMP22 Q01453 2/20 0.38
CYP2C19 P33261 1/20 0.38
STAT6 P42226 1/20 0.38
HIF1A Q16665 1/20 0.38
NPC1 O15118 1/20 0.38
MTOR P42345 1/20 0.38
RAB9A P51151 1/20 0.38
BLM P54132 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CYP19A1 P11511 1/20 0.37
KDM4E B2RXH2 1/20 0.33
TFPI2 P48307 1/20 0.33
TSHR P16473 1/20 0.33

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
Carbamic Acid SCHEMBL28815467 0.94 CYP19A1 (0.36) LMNAMAPK1TP53NFKB1THPO
SCHEMBL556690 0.92 CYP19A1 (0.38) CYP19A1
Formic Acid SCHEMBL28540793 0.89 CYP19A1 (0.36) CYP19A1
SCHEMBL36696 0.75 TFPI2 (0.34) LMNAMAPK1TP53NFKB1THPO
SCHEMBL11771538 0.74 CYP19A1 (0.35) CYP19A1
SCHEMBL28644478 0.73 LMNA (0.37) LMNAMAPK1TP53NFKB1THPO
SCHEMBL2537579 0.72 CYP19A1 (0.33) LMNATP53NFKB1THPOGMNN
SCHEMBL28760355 0.72 LMNA (0.30) LMNATP53NFKB1THPOGMNN
SCHEMBL9900814 0.72
SCHEMBL14114628 0.71 PDE4D (0.34) CYP2C19CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1719789-B1 Hyperbranched polymer and cycloaliphatic epoxy resin thermosets DELPHI TECH INC (US) 2008-10-01 EP claimed
US-20060252892-A1 Hyperbranched polymer and cycloaliphatic epoxy resin thermosets INTEL CORPORATION 2006-11-09 US claimed
EP-1719789-A1 Hyperbranched polymer and cycloaliphatic epoxy resin thermosets Delphi Technologies, Inc. (US) 2006-11-08 EP claimed
US-7754824-B2 Dendritic polyol, cycloaliphatic epoxy resin and cationic initiator DELPHI TECHNOLOGIES, INC. (US) 2010-07-13 US disclosed
US-20090082528-A1 HYPERBRANCHED POLYMER AND CYCLOALIPHATIC EPOXY RESIN THERMOSETS INTEL CORPORATION 2009-03-26 US disclosed
EP-1719789-B1 Hyperbranched polymer and cycloaliphatic epoxy resin thermosets DELPHI TECH INC (US) 2008-10-01 EP disclosed
US-20060252892-A1 Hyperbranched polymer and cycloaliphatic epoxy resin thermosets INTEL CORPORATION 2006-11-09 US disclosed
EP-1719789-A1 Hyperbranched polymer and cycloaliphatic epoxy resin thermosets Delphi Technologies, Inc. (US) 2006-11-08 EP disclosed
US-5364691-A Alk-1-enyloxy carbonates ISP INVESTMENTS INC. (US) 1994-11-15 US disclosed