Brefeldin A

Brefeldin A

SCHEMBL30460472

C[C@@H]1CCCC=C[C@@H]2C[C@H](O)C[C@H]2[C@@H](O)/C=C/C(=O)O1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 1.00
RAB9A P51151 5/20 1.00
LMNA P02545 4/20 1.00
SMN1; SMN2 Q16637 3/20 1.00
PRNP P04156 2/20 1.00
HTT P42858 2/20 1.00
NPSR1 Q6W5P4 2/20 1.00
THRB P10828 1/20 1.00
NR0B1 P51843 1/20 1.00
MEN1 O00255 1/20 1.00
KMT2A Q03164 1/20 1.00
TDP1 Q9NUW8 1/20 1.00
HIF1A Q16665 1/20 1.00
GMNN O75496 1/20 0.54
MTOR P42345 1/20 0.54
BLM P54132 1/20 0.54
PMP22 Q01453 1/20 0.54
ESR1 P03372 1/20 0.38
HPGD P15428 1/20 0.38
STAT3 P40763 1/20 0.38

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
Brefeldin A SCHEMBL4967925 1.00 NPC1 (1.00) NPC1RAB9ALMNASMN1; SMN2PRNP
Brefeldin A SCHEMBL17167480 1.00 NPC1 (1.00) NPC1RAB9ALMNASMN1; SMN2PRNP
Brefeldin A SCHEMBL30460466 1.00 NPC1 (1.00) NPC1RAB9ALMNASMN1; SMN2PRNP
Brefeldin A SCHEMBL12648486 1.00 NPC1 (1.00) NPC1RAB9ALMNASMN1; SMN2PRNP
Brefeldin A SCHEMBL29268 1.00 NPC1 (1.00) NPC1RAB9ALMNASMN1; SMN2PRNP
Brefeldin A SCHEMBL13073124 1.00 NPC1 (1.00) NPC1RAB9ALMNASMN1; SMN2PRNP
Brefeldin A SCHEMBL4967944 1.00 NPC1 (1.00) NPC1RAB9ALMNASMN1; SMN2PRNP
Brefeldin A SCHEMBL4345242 1.00 NPC1 (1.00) NPC1RAB9ALMNASMN1; SMN2PRNP
Brefeldin A SCHEMBL8264765 1.00 NPC1 (1.00) NPC1RAB9ALMNASMN1; SMN2PRNP
Brefeldin A SCHEMBL26040278 1.00 NPC1 (1.00) NPC1RAB9ALMNASMN1; SMN2PRNP

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
CN-113773287-B Bioactive secondary metabolite and preparation and application thereof 中国科学院沈阳应用生态研究所 2023-06-16 CN disclosed