Bicarbonate

Bicarbonate

SCHEMBL11516562

CC(CC(C)(C)OOC(C)(C)C)OO.CC(CC(C)(C)OOC(C)(C)C)OO.O=C(O)O.O=C(O)O

nearest known ligand 0.31

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 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL8462329 0.81 TSHR (0.31) TSHRTDP1
SCHEMBL7753387 0.78 TSHR (0.32) TSHRTDP1
SCHEMBL362758 0.78 TSHR (0.32) TSHRTDP1
SCHEMBL7755958 0.78
SCHEMBL9414410 0.76
SCHEMBL11423623 0.76 LMNA (0.44) TSHRTDP1
SCHEMBL7792613 0.76
SCHEMBL11606546 0.76 TSHR (0.33) TSHR
SCHEMBL8616131 0.74 TSHR (0.32) TSHRTDP1
SCHEMBL8616134 0.74 TSHR (0.32) TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4175101-A Acrylonitrile block terpolymer barrier resins STANDARD OIL COMPANY (US) 1979-11-20 US disclosed
US-3994994-A PHOTOCONDUCTIVE SEGMENTS XEROX CORPORATION (US) 1976-11-30 US disclosed