Bicarbonate

Bicarbonate

SCHEMBL28611463

CCCCCCCCCCCCCCCCCCCCCCCCCCC(C)C1CCCCC1.O=C(O)O.O=C(O)O

nearest known ligand 0.46

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 7)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 8/20 0.44
EPHX2 P34913 2/20 0.44
TSHR P16473 1/20 0.43
ACE2 Q9BYF1 1/20 0.43
GPR84 Q9NQS5 3/20 0.43
FFAR1 O14842 1/20 0.43
NAAA Q02083 2/20 0.42

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
Bicarbonate SCHEMBL28454760 1.00 EPHX1 (0.44) EPHX1EPHX2TSHRACE2GPR84
SCHEMBL9213061 0.91 SHBG (0.41) EPHX1EPHX2TSHR
SCHEMBL4490677 0.91 SHBG (0.41) EPHX1EPHX2TSHR
SCHEMBL9214846 0.91 SHBG (0.41) EPHX1EPHX2TSHR
SCHEMBL11085237 0.91 SHBG (0.41) EPHX1EPHX2TSHR
SCHEMBL3421946 0.91 SHBG (0.41) EPHX1EPHX2TSHR
SCHEMBL11677493 0.91 SHBG (0.41) EPHX1EPHX2TSHR
SCHEMBL4723686 0.91 SHBG (0.41) EPHX1EPHX2TSHR
SCHEMBL31122641 0.91 SHBG (0.41) EPHX1EPHX2TSHR
SCHEMBL2722037 0.91 SHBG (0.41) EPHX1EPHX2TSHR

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
CN-107344973-B Catalyst component for olefin polymerization, catalyst system and application thereof 中国石油化工股份有限公司 2021-03-16 CN disclosed
CN-107344978-B Catalyst component for olefin polymerization, catalyst system and application thereof 中国石油化工股份有限公司 2020-06-09 CN disclosed