SCHEMBL28866712

SCHEMBL28866712

Nc1cc2nc3ccccc3nc2cc1N.[Mn]

nearest known ligand 0.95

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.95
KMT2A Q03164 6/20 0.95
POLB P06746 4/20 0.95
NPC1 O15118 3/20 0.95
MEN1 O00255 2/20 0.95
USP2 O75604 1/20 0.95
CACNA1B Q00975 1/20 0.95
APBA1 Q02410 1/20 0.95
L3MBTL1 Q9Y468 1/20 0.95
NQO2 P16083 6/20 0.59
ALDH1A1 P00352 7/20 0.55
HPGD P15428 5/20 0.55
KDM4E B2RXH2 5/20 0.55
GAA P10253 4/20 0.55
HSD17B10 Q99714 3/20 0.55
RAB9A P51151 5/20 0.48
GLA P06280 4/20 0.48
LMNA P02545 3/20 0.48
PTBP1 P26599 1/20 0.48
RCE1 Q9Y256 1/20 0.48

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
SCHEMBL188079 0.97 MAPT (1.00) MAPTKMT2APOLBNPC1MEN1
SCHEMBL29351539 0.97 MAPT (1.00) MAPTKMT2APOLBNPC1MEN1
Hydrochloric Acid SCHEMBL27822095 0.95 MAPT (0.95) MAPTKMT2APOLBNPC1MEN1
Ammonia Solution, Strong SCHEMBL18919853 0.95 MAPT (0.95) MAPTKMT2APOLBNPC1MEN1
Hydrochloric Acid SCHEMBL27822317 0.92 MAPT (0.90) MAPTKMT2APOLBNPC1MEN1
SCHEMBL15174658 0.92 MAPT (0.90) MAPTKMT2APOLBNPC1MEN1
Formamide SCHEMBL9342277 0.86 MAPT (0.78) MAPTKMT2APOLBNPC1MEN1
SCHEMBL29428970 0.83 KMT2A (0.72) MAPTKMT2APOLBNPC1MEN1
SCHEMBL837057 0.83 KMT2A (0.72) MAPTKMT2APOLBNPC1MEN1
SCHEMBL1913858 0.81 MAPT (0.71) MAPTKMT2APOLBNPC1MEN1

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-108918478-A A kind of method of quantitative detection alpha-glucosidase activity 南京医科大学 2018-11-30 CN claimed
CN-108918478-A A kind of method of quantitative detection alpha-glucosidase activity 南京医科大学 2018-11-30 CN disclosed