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Beta-Amyrin Acetate

Beta-Amyrin Acetate

SCHEMBL4938185

CC(=O)OC1CC[C@]2(C)[C@H]3CC=C4[C@@H]5CC(C)(C)CC[C@]5(C)CC[C@@]4(C)[C@]3(C)CC[C@H]2C1(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 1.00
▸ KMT2A Q03164 1/20 1.00
▸ PTPN1 P18031 11/20 0.81
▸ USP2 O75604 2/20 0.81
▸ PTPN2 P17706 4/20 0.68
▸ EGFR P00533 1/20 0.65
▸ CETP P11597 3/20 0.64
▸ ACP1 P24666 1/20 0.64
▸ ALOX5 P09917 1/20 0.64
▸ ALOX15 P16050 1/20 0.64
▸ POLB P06746 1/20 0.62
▸ RECQL P46063 1/20 0.62

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
Beta-Amyrin Acetate SCHEMBL4938189 1.00 MEN1 (1.00) MEN1KMT2APTPN1USP2PTPN2
Beta-Amyrin Acetate SCHEMBL29602022 1.00 MEN1 (1.00) MEN1KMT2APTPN1USP2PTPN2
Beta-Amyrin Acetate SCHEMBL29437228 1.00 MEN1 (1.00) MEN1KMT2APTPN1USP2PTPN2
Beta-Amyrin Acetate SCHEMBL28103410 1.00 MEN1 (1.00) MEN1KMT2APTPN1USP2PTPN2
SCHEMBL9346767 0.90 MEN1 (0.81) MEN1KMT2APTPN1USP2PTPN2
SCHEMBL11523332 0.90 MEN1 (0.81) MEN1KMT2APTPN1USP2ALOX5
SCHEMBL11523338 0.90 MEN1 (0.81) MEN1KMT2APTPN1USP2ALOX5
SCHEMBL9346773 0.90 MEN1 (0.81) MEN1KMT2APTPN1USP2PTPN2
SCHEMBL15513622 0.90 MEN1 (0.81) MEN1KMT2APTPN1USP2ALOX5
SCHEMBL25132324 0.90 MEN1 (0.81) MEN1KMT2APTPN1USP2PTPN2

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
US-20080103201-A1 Novel alpha-Glucosidase inhibitor from Tabernaemontana dichotoma WIJAYABANDARA MIRIHANAGE DON J 2008-05-01 — — US disclosed
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