Liquiritin

Liquiritin

SCHEMBL24835038

O=C1CC(c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)Oc2cc(O)ccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 1/20 1.00
▸ P4HB P07237 1/20 1.00
▸ TRPV1 Q8NER1 1/20 1.00
▸ PTPN1 P18031 4/20 0.70
▸ SLCO2B1 O94956 2/20 0.70
▸ SYNJ2 O15056 1/20 0.63
▸ XDH P47989 1/20 0.60
▸ KDM1A O60341 1/20 0.59
▸ CYP19A1 P11511 6/20 0.58
▸ TUBB4A P04350 1/20 0.58
▸ TUBB P07437 1/20 0.58
▸ YES1 P07947 1/20 0.58
▸ TUBA3C P0DPH7 1/20 0.58
▸ TUBA1B P68363 1/20 0.58
▸ TUBA4A P68366 1/20 0.58
▸ TUBB4B P68371 1/20 0.58
▸ TUBB3 Q13509 1/20 0.58
▸ TUBB2A Q13885 1/20 0.58
▸ TUBB8 Q3ZCM7 1/20 0.58
▸ TUBA3E Q6PEY2 1/20 0.58

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
Liquiritin SCHEMBL13906116 1.00 TRPA1 (1.00) TRPA1P4HBTRPV1PTPN1SLCO2B1
Liquiritin SCHEMBL13931703 1.00 TRPA1 (1.00) TRPA1P4HBTRPV1PTPN1SLCO2B1
Liquiritin SCHEMBL26113334 1.00 TRPA1 (1.00) TRPA1P4HBTRPV1PTPN1SLCO2B1
Liquiritin SCHEMBL29536850 1.00 TRPA1 (1.00) TRPA1P4HBTRPV1PTPN1SLCO2B1
Liquiritin SCHEMBL24209243 1.00 TRPA1 (1.00) TRPA1P4HBTRPV1PTPN1SLCO2B1
Liquiritin SCHEMBL15091079 1.00 TRPA1 (1.00) TRPA1P4HBTRPV1PTPN1SLCO2B1
SCHEMBL29351306 0.94 TRPA1 (0.89) TRPA1P4HBTRPV1PTPN1SLCO2B1
SCHEMBL10926327 0.88 TRPA1 (0.79) TRPA1P4HBTRPV1PTPN1SLCO2B1
SCHEMBL27939664 0.88 TRPA1 (0.79) TRPA1P4HBTRPV1PTPN1SLCO2B1
SCHEMBL31504735 0.88 TRPA1 (0.79) TRPA1P4HBTRPV1PTPN1SLCO2B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023193244-A1 SUPRAMOLECULAR SELF-ASSEMBLY SYSTEM 北京睿创康泰医药研究院有限公司 2023-10-12 — — WO claimed
US-20240237690-A1 Licorice Compounds and Their Use as Flavor Modifiers FIRMENICH SA (CH) 2024-07-18 — — US disclosed
US-20240237690-A1 Licorice Compounds and Their Use as Flavor Modifiers FIRMENICH SA (CH) 2024-07-18 — — US disclosed
WO-2023193244-A1 SUPRAMOLECULAR SELF-ASSEMBLY SYSTEM 北京睿创康泰医药研究院有限公司 2023-10-12 — — WO disclosed
WO-2023274808-A1 LICORICE COMPOUNDS AND THEIR USE AS FLAVOR MODIFIERS FIRMENICH SA (CH) 2023-01-05 — — WO disclosed
CN-115317497-A Application of liquiritin in preparing thoracic aorta vasodilation medicine 宁夏医科大学 2022-11-11 — — CN disclosed
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