Glucuronate

Glucuronate

SCHEMBL8935076

O=C(O)[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O.Oc1cccc2ccccc12

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.49
EPHX1 P07099 1/20 0.43
NR4A1 P22736 1/20 0.40
NR4A2 P43354 1/20 0.40
NR4A3 Q92570 1/20 0.40
GRIN2D O15399 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2B Q13224 1/20 0.36
GRIN2C Q14957 1/20 0.36
GAA P10253 2/20 0.35
KMT2A Q03164 2/20 0.35
POLB P06746 1/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
HSD17B10 Q99714 2/20 0.35
APAF1 O14727 1/20 0.35
NSD2 O96028 1/20 0.35
CASP3 P42574 1/20 0.35
SENP8 Q96LD8 1/20 0.35

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
Anthracene SCHEMBL4530438 0.82 POLB (0.43) CYP1A2GAAKMT2APOLBKDM4E
Anthracene SCHEMBL4516327 0.82 POLB (0.43) CYP1A2GAAKMT2APOLBKDM4E
Pyrene SCHEMBL4521971 0.80 KMT2A (0.41) CYP1A2EPHX1GAAKMT2APOLB
Glucuronate SCHEMBL4908209 0.79 HDAC8 (0.54) KMT2APOLBKDM4EALDH1A1HPGD
Glucuronate SCHEMBL28065767 0.76 IDUA (0.41) KMT2AALDH1A1ABCG2MEN1
Glucuronate SCHEMBL28065814 0.76 IDUA (0.41) KMT2AALDH1A1ABCG2MEN1
Glucuronate SCHEMBL19410655 0.75 CES1 (0.44) CYP1A2GAAKMT2APOLBALDH1A1
1-Naphthol SCHEMBL28176338 0.75 CYP1A2 (0.53) CYP1A2LGALS9LGALS8LGALS1LGALS3
1-Naphthol SCHEMBL7522683 0.74 CYP1A2 (0.81) CYP1A2NR4A1NR4A2NR4A3GRIN2D
Glucuronate SCHEMBL25253417 0.74 IDUA (0.50) KDM4EALDH1A1HPGDHSD17B10GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0620939-A4 AUTOMATED MULTICOMPARTMENTAL CELL CULTURE SYSTEM. CORNELL RES FOUNDATION INC (US) 1996-05-29 EP disclosed
EP-0620939-A1 AUTOMATED MULTICOMPARTMENTAL CELL CULTURE SYSTEM CORNELL RESEARCH FOUNDATION, INC. (US) 1994-10-26 EP disclosed
WO-1993011498-A1 AUTOMATED MULTICOMPARTMENTAL CELL CULTURE SYSTEM CORNELL RESEARCH FOUNDATION, INC. (US) 1993-06-10 WO disclosed