Gambogic Acid

Gambogic Acid

SCHEMBL20181159

CC(C)=CCCC1(C)C=Cc2c(O)c3c(c(CC=C(C)C)c2O1)OC12C(=CC4CC1C(C)(C)OC2(C/C=C(\C)C(=O)O)C4=O)C3=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 6/20 1.00
▸ MAPT P10636 6/20 1.00
▸ MAPK1 P28482 6/20 1.00
▸ HSD17B10 Q99714 6/20 1.00
▸ PTPN1 P18031 6/20 1.00
▸ CYP3A4 P08684 5/20 1.00
▸ SMN1; SMN2 Q16637 5/20 1.00
▸ ALOX15 P16050 5/20 1.00
▸ HPGD P15428 3/20 1.00
▸ BLM P54132 3/20 1.00
▸ KDM4E B2RXH2 3/20 1.00
▸ IKBKB O14920 3/20 1.00
▸ HSP90AA1 P07900 1/20 1.00
▸ HSP90AB1 P08238 1/20 1.00
▸ BCL2 P10415 1/20 1.00
▸ TXN P10599 1/20 1.00
▸ BCL2L1 Q07817 1/20 1.00
▸ MCL1 Q07820 1/20 1.00
▸ BCL2A1 Q16548 1/20 1.00
▸ SPTSSB Q8NFR3 1/20 1.00

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
Gambogic Acid SCHEMBL12045553 1.00 TP53 (1.00) TP53MAPTMAPK1HSD17B10PTPN1
Gambogic Acid SCHEMBL12025441 1.00 TP53 (1.00) TP53MAPTMAPK1HSD17B10PTPN1
Gambogic Acid SCHEMBL7946944 1.00 TP53 (1.00) TP53MAPTMAPK1HSD17B10PTPN1
Gambogic Acid SCHEMBL12751296 1.00 TP53 (1.00) TP53MAPTMAPK1HSD17B10PTPN1
Gambogic Acid SCHEMBL134152 1.00 TP53 (1.00) TP53MAPTMAPK1HSD17B10PTPN1
Gambogic Acid SCHEMBL24089082 1.00 TP53 (1.00) TP53MAPTMAPK1HSD17B10PTPN1
Gambogic Acid SCHEMBL13685811 1.00 TP53 (1.00) TP53MAPTMAPK1HSD17B10PTPN1
Gambogic Acid SCHEMBL13685812 1.00 TP53 (1.00) TP53MAPTMAPK1HSD17B10PTPN1
Gambogic Acid SCHEMBL12859660 1.00 TP53 (1.00) TP53MAPTMAPK1HSD17B10PTPN1
Gambogic Acid SCHEMBL12026374 1.00 TP53 (1.00) TP53MAPTMAPK1HSD17B10PTPN1

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-2018092725-A1 p53 DEGRADATION INDUCING MOLECULE AND PHARMACEUTICAL COMPOSITION 学校法人東京理科大学 2018-05-24 — — WO disclosed
Send feedback