Trioxsalen

Trioxsalen

SCHEMBL28089383

C=CC.Cc1cc2cc3c(C)cc(=O)oc3c(C)c2o1

nearest known ligand 0.85

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.85
ALDH1A1 P00352 5/20 0.85
MAOA P21397 3/20 0.85
MAPK1 P28482 3/20 0.85
CYP1A2 P05177 2/20 0.85
CYP3A4 P08684 2/20 0.85
HTR2C P28335 1/20 0.85
ADORA2A P29274 1/20 0.85
MAOB P27338 3/20 0.47
CYP1A1 P04798 1/20 0.43
CYP1B1 Q16678 1/20 0.43
HSD17B10 Q99714 4/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
HPGD P15428 3/20 0.42
TSHR P16473 2/20 0.42
GAA P10253 4/20 0.41
GLA P06280 2/20 0.41
MAPT P10636 3/20 0.41
UBE2N P61088 1/20 0.41
KMT2A Q03164 2/20 0.40

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
Trioxsalen SCHEMBL1252 0.92 KDM4E (1.00) KDM4EALDH1A1MAOAMAPK1CYP1A2
Trioxsalen SCHEMBL4954831 0.92 KDM4E (1.00) KDM4EALDH1A1MAOAMAPK1CYP1A2
Trioxsalen SCHEMBL29432841 0.92 KDM4E (1.00) KDM4EALDH1A1MAOAMAPK1CYP1A2
Trioxsalen SCHEMBL11442670 0.91 KDM4E (0.97) KDM4EALDH1A1MAOAMAPK1CYP1A2
Trioxsalen SCHEMBL28103198 0.85 KDM4E (0.85) KDM4EALDH1A1MAOAMAPK1CYP1A2
Trioxsalen SCHEMBL28285134 0.85 KDM4E (0.85) KDM4EALDH1A1MAOAMAPK1CYP1A2
Trioxsalen SCHEMBL28215231 0.85 KDM4E (0.85) KDM4EALDH1A1MAOAMAPK1CYP1A2
Trioxsalen SCHEMBL28205170 0.83 KDM4E (0.81) KDM4EALDH1A1MAOAMAPK1CYP1A2
Trioxsalen SCHEMBL28143570 0.83 KDM4E (0.81) KDM4EALDH1A1MAOAMAPK1CYP1A2
Trioxsalen SCHEMBL28103904 0.81 KDM4E (0.76) KDM4EALDH1A1MAOAMAPK1CYP1A2

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
CN-105829479-B Acrylic adhesive composition and adhesive tape 日绊株式会社 2017-12-29 CN disclosed
CN-105829479-A Acrylic adhesive composition and adhesive tape 日绊株式会社 2016-08-03 CN disclosed