Broxyquinoline

Broxyquinoline

SCHEMBL29485693

[Al+3].[O-]c1c(Br)cc(Br)c2cccnc12.[O-]c1c(Br)cc(Br)c2cccnc12.[O-]c1c(Br)cc(Br)c2cccnc12

nearest known ligand 0.61

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.61
HSP90AA1 P07900 4/20 0.61
HTT P42858 4/20 0.61
MEN1 O00255 3/20 0.61
KMT2A Q03164 3/20 0.61
TDP1 Q9NUW8 3/20 0.61
TP53 P04637 3/20 0.61
SMN1; SMN2 Q16637 3/20 0.61
USP2 O75604 1/20 0.61
ALDH1A1 P00352 3/20 0.47
MAPT P10636 3/20 0.47
APAF1 O14727 1/20 0.47
TDP2 O95551 1/20 0.47
CASP3 P42574 1/20 0.47
SENP8 Q96LD8 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
NPSR1 Q6W5P4 3/20 0.42
RXFP1 Q9HBX9 2/20 0.42
LMNA P02545 3/20 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
Broxyquinoline SCHEMBL5712599 1.00 KDM4E (0.61) KDM4EHSP90AA1HTTMEN1KMT2A
SCHEMBL9976765 0.78 KDM4E (0.66) KDM4EHSP90AA1HTTMEN1KMT2A
Broxyquinoline SCHEMBL30485535 0.76 KDM4E (1.00) KDM4EHSP90AA1HTTMEN1KMT2A
SCHEMBL14212918 0.76 KDM4E (0.62) KDM4EHSP90AA1HTTMEN1KMT2A
Broxyquinoline SCHEMBL29607319 0.76 KDM4E (1.00) KDM4EHSP90AA1HTTMEN1KMT2A
SCHEMBL2204811 0.76 HSP90AA1 (0.62) KDM4EHSP90AA1HTTMEN1KMT2A
Broxyquinoline SCHEMBL115293 0.76 KDM4E (1.00) KDM4EHSP90AA1HTTMEN1KMT2A
SCHEMBL1714224 0.76 KMT2A (0.58) KDM4EHSP90AA1HTTMEN1KMT2A
Broxyquinoline SCHEMBL22734870 0.74 KDM4E (0.96) KDM4EHSP90AA1HTTMEN1KMT2A
Broxyquinoline SCHEMBL31157810 0.74 KDM4E (0.96) KDM4EHSP90AA1HTTMEN1KMT2A

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-114141971-A Organic electroluminescent device containing phenanthryl triarylamine compound and application thereof 江苏三月科技股份有限公司 2022-03-04 CN disclosed