Bitalin A

Bitalin A

SCHEMBL29516695

C=C(CO)[C@@H]1Cc2cc(C(C)=O)ccc2O1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 1.00
▸ APEX1 P27695 1/20 1.00
▸ RECQL P46063 1/20 1.00
▸ TDP1 Q9NUW8 1/20 0.46
▸ MAPT P10636 4/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ ITGB3 P05106 1/20 0.39
▸ ITGA2B P08514 1/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ HPGD P15428 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ AKR1B1 P15121 1/20 0.38
▸ MEN1 O00255 3/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ MAPK1 P28482 2/20 0.36
▸ CYP3A4 P08684 1/20 0.36

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
Bitalin A SCHEMBL31469140 1.00 POLB (1.00) POLBAPEX1RECQLTDP1MAPT
Tremetone SCHEMBL4743840 0.86 POLB (0.75) POLBAPEX1RECQLTDP1MAPT
Tremetone SCHEMBL4743839 0.86 POLB (0.75) POLBAPEX1RECQLTDP1MAPT
SCHEMBL28394415 0.79 POLB (0.65) POLBAPEX1RECQLTDP1MAPT
Viscidone SCHEMBL6266796 0.77 POLB (0.63) POLBAPEX1RECQLTDP1MAPT
SCHEMBL1092598 0.75 TDP1 (0.77) POLBAPEX1RECQLTDP1MAPT
SCHEMBL16742283 0.73 POLB (0.57) POLBAPEX1RECQLTDP1MAPT
SCHEMBL31020314 0.70 POLB (0.54) POLBAPEX1RECQLKDM4EAKR1B1
SCHEMBL1727478 0.69 POLB (0.52) POLBAPEX1RECQLTDP1MAPT
SCHEMBL20594954 0.69 POLB (0.52) POLBAPEX1RECQLTDP1RAB9A

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-114224908-A Application of cordyceps militaris polysaccharide in preparation of product for regulating intestinal flora and metabolite disorder caused by high-fat diet 暨南大学 2022-03-25 — — CN disclosed
Send feedback