Bauerine C

Bauerine C

SCHEMBL17867404

Cn1c2c(O)nccc2c2ccc(Cl)c(Cl)c21

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.48
CLK1 P49759 2/20 0.33
KDM4E B2RXH2 1/20 0.33
BRD4 O60885 1/20 0.33
LMNA P02545 1/20 0.33
HSP90AA1 P07900 1/20 0.33
MAPT P10636 1/20 0.33
METAP2 P50579 1/20 0.33
METAP1 P53582 1/20 0.33
HASPIN Q8TF76 1/20 0.33
DYRK2 Q92630 1/20 0.33
DYRK1A Q13627 2/20 0.33
MAOA P21397 1/20 0.33
CLK3 P49761 1/20 0.32
CYP3A4 P08684 1/20 0.31
MAPK1 P28482 1/20 0.31
MAT2A P31153 1/20 0.30
BCHE P06276 1/20 0.30
ACHE P22303 1/20 0.30

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
Bauerine B SCHEMBL3305155 0.71 SIRT2 (0.44) SIRT2HASPINDYRK1AMAOA
SCHEMBL911494 0.68
SCHEMBL18300750 0.67 MAPT (0.34) KDM4EBRD4LMNAHSP90AA1MAPT
SCHEMBL8978431 0.66 CYP3A4 (0.40) KDM4EBRD4LMNAHSP90AA1MAPT
Bauerine C SCHEMBL18134620 0.65 SIRT2 (1.00) SIRT2CLK1KDM4EBRD4HASPIN
SCHEMBL15047831 0.63 TLR8 (0.38) KDM4ELMNAHSP90AA1MAPTMAOA
SCHEMBL21168174 0.63 DYRK1A (0.57) HASPINDYRK2DYRK1AMAOABCHE
SCHEMBL26912818 0.62 SIRT2 (0.45) SIRT2CLK1DYRK1ACLK3MAT2A
SCHEMBL8139929 0.60 CYP19A1 (0.50) MAPTHASPINDYRK2DYRK1ACYP3A4
SCHEMBL9883160 0.60 CYP1A2 (0.34) MAPTCYP3A4

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
US-20190309289-A1 PROCESSES AND HOST CELLS FOR GENOME, PATHWAY, AND BIOMOLECULAR ENGINEERING ENEVOLV, INC. 2019-10-10 US disclosed
US-10370654-B2 Processes and host cells for genome, pathway, and biomolecular engineering ENEVOLV, INC. (US) 2019-08-06 US disclosed
US-20180320170-A1 PROCESSES AND HOST CELLS FOR GENOME, PATHWAY, AND BIOMOLECULAR ENGINEERING ENEVOLV, INC. 2018-11-08 US disclosed
US-9944925-B2 Processes and host cells for genome, pathway, and biomolecular engineering ENEVOLV, INC. 2018-04-17 US disclosed
US-20160186168-A1 PROCESSES AND HOST CELLS FOR GENOME, PATHWAY, AND BIOMOLECULAR ENGINEERING ENEVOLV, INC. 2016-06-30 US disclosed