Oxirane

Oxirane

SCHEMBL28311998

C1CO1.C=Cc1ncccc1C

nearest known ligand 0.39

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 1/20 0.39
NOS1 P29475 1/20 0.39
NOS2 P35228 1/20 0.39
CTH P32929 1/20 0.38
LMNA P02545 1/20 0.34
METAP2 P50579 1/20 0.34
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
PLAU P00749 1/20 0.33
KDM4E B2RXH2 1/20 0.33
CYP2A6 P11509 1/20 0.33
BTK Q06187 1/20 0.33
OPRL1 P41146 2/20 0.33
L3MBTL1 Q9Y468 4/20 0.33
CCR1 P32246 1/20 0.33
CCR5 P51681 1/20 0.33
CCR8 P51685 1/20 0.33
MAPT P10636 1/20 0.32
IDH1 O75874 1/20 0.32
HSP90AA1 P07900 1/20 0.31

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
SCHEMBL31590419 0.90
SCHEMBL159686 0.90
Hydrochloric Acid SCHEMBL4624039 0.88 NOS3 (0.45) NOS3NOS1NOS2CTHLMNA
Formic Acid SCHEMBL31245498 0.81 CTH (0.41) NOS3NOS1NOS2CTHLMNA
Trifluoromethanesulfonic Acid SCHEMBL27819589 0.74 KDM4E (0.37) NOS3NOS1NOS2CTHLMNA
SCHEMBL16286075 0.72 NOS3 (0.41) NOS3NOS1NOS2CTHLMNA
SCHEMBL661299 0.71
SCHEMBL9160147 0.71 NOS2 (0.48) NOS3NOS2BTKL3MBTL1CCR1
SCHEMBL5754946 0.71 NOS3 (0.43) NOS3NOS1NOS2CTHLMNA
SCHEMBL20310312 0.70 CTH (0.48) NOS3NOS1NOS2CTHMETAP2

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-106519588-B It is functionalized chromophoric polymers point and its bioconjugate body 华盛顿大学商业化中心 2019-08-20 CN disclosed
CN-106519588-A Functionalized chromophoric polymer dots and bioconjugates thereof 华盛顿大学商业化中心 2017-03-22 CN disclosed