Dibrompropamidine

Dibrompropamidine

SCHEMBL28086367

N=C(N)c1ccc(OCCCOc2ccc(C(=N)N)cc2)cc1.N=C(N)c1ccc(OCCCOc2ccc(C(=N)N)cc2Br)c(Br)c1

nearest known ligand 0.85

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 4/20 0.85
ST14 Q9Y5Y6 4/20 0.85
PLAU P00749 3/20 0.85
TMPRSS2 O15393 2/20 0.68
PRSS1 P07477 6/20 0.66
PRMT1 Q99873 3/20 0.61
PRMT5 O14744 1/20 0.61
SLC22A2 O15244 1/20 0.61
SLC22A1 O15245 1/20 0.61
PTP4A3 O75365 1/20 0.61
SLC22A3 O75751 1/20 0.61
F10 P00742 1/20 0.61
PLG P00747 1/20 0.61
S100B P04271 1/20 0.61
CHRM2 P08172 1/20 0.61
CHRM4 P08173 1/20 0.61
CHRM5 P08912 1/20 0.61
ADRA2A P08913 1/20 0.61
CYP2D6 P10635 1/20 0.61
AOC1 P19801 1/20 0.61

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
Dibrompropamidine SCHEMBL292947 0.92 F2 (1.00) F2ST14PLAUPRSS1
Dibrompropamidine SCHEMBL29709297 0.92 F2 (1.00) F2ST14PLAUPRSS1
Dibrompropamidine SCHEMBL21083095 0.91 F2 (0.97) F2ST14PLAUPRSS1
SCHEMBL14599538 0.88 F2 (0.90) F2ST14PLAUPRSS1
SCHEMBL597315 0.88 F2 (0.90) F2ST14PLAUPRSS1
SCHEMBL20450462 0.87 F2 (0.65) F2ST14PLAUTMPRSS2PRSS1
Propamidine SCHEMBL231060 0.82 TMPRSS2 (1.00) F2ST14PLAUTMPRSS2PRSS1
SCHEMBL12989557 0.82 F2 (0.76) F2ST14PLAUTMPRSS2PRSS1
SCHEMBL16360744 0.82 F2 (0.79) F2ST14PLAUPRSS1
SCHEMBL22824438 0.81 F2 (0.78) F2ST14PLAUPRSS1

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-103717597-B Heterocyclic compounds as kinase inhibitors 原真股份有限公司 2017-07-04 CN disclosed
CN-103492389-B Pyrazolo [4,3-d] pyrimidine as inhibitors of kinases 原真股份有限公司 2016-09-14 CN disclosed