Beta-Amyrin

Beta-Amyrin

SCHEMBL18376076

CC1(C)CC[C@]2(C)CC[C@]3(C)C(=CCC4C3(C)CCC3C(C)(C)[C@@H](O)CC[C@@]34C)C2C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 2/20 1.00
▸ ALOX5 P09917 4/20 0.79
▸ CES1 P23141 3/20 0.77
▸ CES2 O00748 1/20 0.77
▸ PTPN1 P18031 9/20 0.77
▸ AKR1B10 O60218 3/20 0.77
▸ AKR1B1 P15121 1/20 0.77
▸ POLB P06746 3/20 0.76
▸ PTPN2 P17706 3/20 0.76
▸ PSMB11 A5LHX3 2/20 0.76
▸ PSMA7 O14818 2/20 0.76
▸ PLA2G1B P04054 2/20 0.76
▸ PTPRC P08575 2/20 0.76
▸ PTPRF P10586 2/20 0.76
▸ F3 P13726 2/20 0.76
▸ PSMB1 P20618 2/20 0.76
▸ ACP1 P24666 2/20 0.76
▸ PSMA1 P25786 2/20 0.76
▸ PSMA2 P25787 2/20 0.76
▸ PSMA3 P25788 2/20 0.76

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 SCHEMBL17124229 1.00 USP2 (1.00) USP2ALOX5CES1CES2PTPN1
Beta-Amyrin SCHEMBL1696465 1.00 USP2 (1.00) USP2ALOX5CES1CES2PTPN1
Beta-Amyrin SCHEMBL12313094 1.00 USP2 (1.00) USP2ALOX5CES1CES2PTPN1
Beta-Amyrin SCHEMBL18687837 1.00 USP2 (1.00) USP2ALOX5CES1CES2PTPN1
Beta-Amyrin SCHEMBL377754 1.00 USP2 (1.00) USP2ALOX5CES1CES2PTPN1
Beta-Amyrin SCHEMBL14828378 1.00 USP2 (1.00) USP2ALOX5CES1CES2PTPN1
Beta-Amyrin SCHEMBL1696463 1.00 USP2 (1.00) USP2ALOX5CES1CES2PTPN1
Beta-Amyrin SCHEMBL3119711 1.00 USP2 (1.00) USP2ALOX5CES1CES2PTPN1
Beta-Amyrin SCHEMBL14226156 1.00 USP2 (1.00) USP2ALOX5CES1CES2PTPN1
Beta-Amyrin SCHEMBL2025280 1.00 USP2 (1.00) USP2ALOX5CES1CES2PTPN1

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-20170009249-A1 MEANS AND METHODS FOR REGULATING SECONDARY METABOLITE PRODUCTION IN PLANTS VIB VZW (BE) 2017-01-12 — — US disclosed
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