Pterocarpin

Pterocarpin

SCHEMBL3231566

COc1ccc2c(c1)OCC1Oc3cc(OC)ccc3C21.COc1ccc2c(c1)OC[C@H]1c3cc4c(cc3O[C@@H]21)OCO4

nearest known ligand 0.85

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Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.85
▸ TDP1 Q9NUW8 2/20 0.85
▸ MAPK1 P28482 1/20 0.85
▸ MAOA P21397 2/20 0.58
▸ MAOB P27338 2/20 0.58
▸ CYP3A4 P08684 1/20 0.58
▸ MEN1 O00255 3/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ DRD2 P14416 2/20 0.41
▸ DRD3 P35462 2/20 0.41
▸ ABCB1 P08183 2/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ LMNA P02545 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.38
▸ HPGD P15428 1/20 0.37

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
Pterocarpin SCHEMBL1248055 0.92 MAPT (1.00) MAPTTDP1MAPK1MAOAMAOB
Pterocarpin SCHEMBL29361907 0.92 MAPT (1.00) MAPTTDP1MAPK1MAOAMAOB
Pterocarpin SCHEMBL1248057 0.92 MAPT (1.00) MAPTTDP1MAPK1MAOAMAOB
SCHEMBL1249201 0.83 MAPT (0.54) MAPTTDP1MAPK1CYP3A4MEN1
Homopterocarpin SCHEMBL29366996 0.82 MAPT (0.80) MAPTTDP1MAPK1MAOAMAOB
Homopterocarpin SCHEMBL12998414 0.82 MAPT (0.80) MAPTTDP1MAPK1MAOAMAOB
Homopterocarpin SCHEMBL31237481 0.82 MAPT (0.80) MAPTTDP1MAPK1MAOAMAOB
Homopterocarpin SCHEMBL12810803 0.82 MAPT (0.80) MAPTTDP1MAPK1MAOAMAOB
Homopterocarpin SCHEMBL12810250 0.82 MAPT (0.80) MAPTTDP1MAPK1MAOAMAOB
SCHEMBL12891389 0.77 MAPT (0.71) MAPTTDP1MAPK1MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010006957-A1 COLORING MEANS COMPRISING NATURAL DYE HENKEL AG & CO. KGAA (DE) 2010-01-21 — — WO disclosed
WO-2009060017-A1 HAIR TREATMENT AGENT COMPRISING TILIROSIDE AND VITAMIN B HENKEL AG & CO. KGAA (DE) 2009-05-14 — — WO disclosed
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