Bicarbonate

Bicarbonate

SCHEMBL28036762

CCCOC(C)Cc1ccccc1-c1ccccc1.O=C(O)O

nearest known ligand 0.54

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
▸ KMT2A Q03164 1/20 0.54
▸ MME P08473 1/20 0.46
▸ ACE P12821 1/20 0.46
▸ CPA1 P15085 1/20 0.46
▸ ACE2 Q9BYF1 1/20 0.46
▸ PPARA Q07869 3/20 0.43
▸ PPARG P37231 1/20 0.43
▸ PTGER1 P34995 1/20 0.42
▸ PTGER4 P35408 1/20 0.42
▸ PTGER3 P43115 1/20 0.42
▸ PTGER2 P43116 1/20 0.42
▸ SCN1A P35498 1/20 0.41
▸ SCN2A Q99250 1/20 0.41
▸ SCN3A Q9NY46 1/20 0.41
▸ SLC6A2 P23975 6/20 0.40
▸ SLC6A4 P31645 6/20 0.40
▸ KDM4E B2RXH2 3/20 0.40
▸ PKM P14618 1/20 0.40
▸ SLC6A3 Q01959 5/20 0.39
▸ CYP2D6 P10635 3/20 0.39

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 SCHEMBL28004213 0.80 NPC1 (0.47) PPARAPPARGPKM
Bicarbonate SCHEMBL27541289 0.78 KMT2A (0.68) KMT2AMMEACECPA1ACE2
SCHEMBL15899527 0.77 SLC6A2 (0.38) KMT2AMMEACECPA1ACE2
SCHEMBL10448877 0.77 KMT2A (0.56) KMT2AMMEACECPA1ACE2
SCHEMBL8161607 0.77 FOLH1 (0.45) KMT2APPARAPPARGFOLH1
SCHEMBL8861750 0.77 KMT2A (0.57) KMT2AMMEACECPA1ACE2
SCHEMBL6493977 0.76 KMT2A (0.51) KMT2AMMEACECPA1ACE2
SCHEMBL10448750 0.76 BRS3 (0.44) PPARAPPARGSCN1ASCN2ASCN3A
SCHEMBL15899526 0.75 THRA (0.38) KMT2AMMEACECPA1ACE2
SCHEMBL1839612 0.75 HTR1A (0.41) SLC6A2SLC6A4SLC6A3CYP2D6KCNH2

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-105008407-B Process for producing propylene block copolymer 东邦钛株式会社 2018-03-06 — — CN disclosed
CN-105008407-A Process for producing propylene block copolymer TOHO TITANIUM CO LTD 2015-10-28 — — CN disclosed
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