Etoposide

Etoposide

SCHEMBL23064754

COc1cc([C@@H]2c3cc4c(cc3C(OC3OC5CO[C@@H](C)OC5C(O)[C@H]3O)[C@H]3COC(=O)C23)OCO4)cc(OC)c1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

TOP2ATOP2B

The experimentally established mechanism targets of Etoposide. 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
TOP2A known ✓ P11388 5/20 1.00
TOP2B known ✓ Q02880 4/20 1.00
CYP3A4 P08684 6/20 1.00
GAA P10253 5/20 1.00
SMN1; SMN2 Q16637 5/20 1.00
LMNA P02545 3/20 1.00
MEN1 O00255 2/20 1.00
KMT2A Q03164 2/20 1.00
NCOA3 Q9Y6Q9 2/20 1.00
HSD17B10 Q99714 2/20 1.00
HIF1A Q16665 2/20 1.00
CYP1A2 P05177 1/20 1.00
CYP2D6 P10635 1/20 1.00
CYP2C9 P11712 1/20 1.00
CYP2C19 P33261 1/20 1.00
NCOA1 Q15788 1/20 1.00
SLCO1B3 Q9NPD5 1/20 1.00
ATM Q13315 1/20 0.75
USP2 O75604 1/20 0.75
ABCC3 O15438 1/20 0.75

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
Etoposide SCHEMBL4259 1.00 CYP3A4 (1.00) CYP3A4GAASMN1; SMN2TOP2ATOP2B
Etoposide SCHEMBL15259344 1.00 CYP3A4 (1.00) CYP3A4GAASMN1; SMN2TOP2ATOP2B
Etoposide SCHEMBL12211570 1.00 CYP3A4 (1.00) CYP3A4GAASMN1; SMN2TOP2ATOP2B
Etoposide SCHEMBL13529274 1.00 CYP3A4 (1.00) CYP3A4GAASMN1; SMN2TOP2ATOP2B
Etoposide SCHEMBL14234116 1.00 CYP3A4 (1.00) CYP3A4GAASMN1; SMN2TOP2ATOP2B
Etoposide SCHEMBL24482748 1.00 CYP3A4 (1.00) CYP3A4GAASMN1; SMN2TOP2ATOP2B
Etoposide SCHEMBL2514265 1.00 CYP3A4 (1.00) CYP3A4GAASMN1; SMN2TOP2ATOP2B
Etoposide SCHEMBL22594950 1.00 CYP3A4 (1.00) CYP3A4GAASMN1; SMN2TOP2ATOP2B
Etoposide SCHEMBL20598257 1.00 CYP3A4 (1.00) CYP3A4GAASMN1; SMN2TOP2ATOP2B
Etoposide SCHEMBL18071930 1.00 CYP3A4 (1.00) CYP3A4GAASMN1; SMN2TOP2ATOP2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021040496-A1 PHARMACEUTICAL COMPOSITION FOR TREATING CANCER, COMPRISING VACCINIA VIRUS AND GRANULOPOIESIS INHIBITOR AS ACTIVE INGREDIENTS 주식회사 바이오녹스 2021-03-04 WO disclosed