Bicarbonate

Bicarbonate

SCHEMBL3979276

O=C(O)O.O=C(c1ccccc1)c1ccccc1O

nearest known ligand 0.73

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
LIG1 P18858 1/20 0.73
GAA P10253 2/20 0.62
MEN1 O00255 1/20 0.62
USP2 O75604 1/20 0.62
KMT2A Q03164 1/20 0.62
KEAP1 Q14145 1/20 0.62
NFE2L2 Q16236 1/20 0.62
AKR1C3 P42330 1/20 0.61
HPGD P15428 7/20 0.60
ALDH1A1 P00352 6/20 0.60
KDM4E B2RXH2 5/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
CA12 O43570 1/20 0.60
CA1 P00915 1/20 0.60
CA2 P00918 1/20 0.60
HMGB1 P09429 1/20 0.60
CA4 P22748 1/20 0.60
CA6 P23280 1/20 0.60
CA7 P43166 1/20 0.60
CA9 Q16790 1/20 0.60

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 SCHEMBL376894 1.00 LIG1 (0.73) LIG1GAAMEN1USP2KMT2A
SCHEMBL29390505 0.98 LIG1 (0.76) LIG1GAAMEN1USP2KMT2A
SCHEMBL22129808 0.98 LIG1 (0.76) LIG1GAAMEN1USP2KMT2A
SCHEMBL36215 0.98 LIG1 (0.76) LIG1GAAMEN1USP2KMT2A
Benzene SCHEMBL6034371 0.98 LIG1 (0.76) LIG1GAAMEN1USP2KMT2A
Benzophenone SCHEMBL178099 0.95 LIG1 (0.73) LIG1GAAMEN1USP2KMT2A
SCHEMBL9717050 0.95 LIG1 (0.73) LIG1GAAMEN1USP2KMT2A
SCHEMBL30661140 0.95 LIG1 (0.73) LIG1GAAMEN1USP2KMT2A
SCHEMBL29254155 0.95 LIG1 (0.73) LIG1GAAMEN1USP2KMT2A
SCHEMBL11308720 0.95 LIG1 (0.73) LIG1GAAMEN1USP2KMT2A

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
CN-104955872-A INTERFACIAL PROCESSES FOR PREPARING PHOTOACTIVE ADDITIVES SABIC GLOBAL TECHNOLOGIES BV 2015-09-30 CN disclosed
EP-1458787-B1 PROCESS FOR THE PRODUCTION OF BRANCHED MELT POLYCARBONATE BY LATE ADDITION OF FRIES-INDUCING CATALYST SABIC INNOVATIVE PLASTICS IP (NL) 2009-05-13 EP disclosed
EP-1458787-A1 PROCESS FOR THE PRODUCTION OF BRANCHED MELT POLYCARBONATE BY LATE ADDITION OF FRIES-INDUCING CATALYST GENERAL ELECTRIC COMPANY (US) 2004-09-22 EP disclosed
WO-2003057758-A1 PROCESS FOR THE PRODUCTION OF BRANCHED MELT POLYCARBONATE BY LATE ADDITION OF FRIES-INDUCING CATALYST GENERAL ELECTRIC COMPANY (US) 2003-07-17 WO disclosed
US-6504002-B1 Melt strength GENERAL ELECTRIC COMPANY 2003-01-07 US disclosed