Methylene Blue Cation

Methylene Blue Cation

SCHEMBL4565666

CN(C)c1ccc2nc3ccc(N(C)C)cc3[s+]c2c1.CN(C)c1ccc2nc3ccc(N(C)C)cc3[s+]c2c1.[Cl-].[Cl-]

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GUCY1A1GUCY1A2GUCY1B1GUCY1B2

The experimentally established mechanism targets of Methylene Blue Cation. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 4/20 0.55
TERT O14746 1/20 0.55
APAF1 O14727 2/20 0.46
EGFR P00533 2/20 0.44
PSMB5 P28074 4/20 0.41
PDE3B Q13370 1/20 0.40
PDE3A Q14432 1/20 0.40
ALDH1A1 P00352 2/20 0.39
ALOX15 P16050 2/20 0.39
HSD17B10 Q99714 2/20 0.39
TSHR P16473 1/20 0.39
MAOA P21397 2/20 0.38
MAOB P27338 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
THRB P10828 2/20 0.38
MAPK1 P28482 2/20 0.38
RECQL P46063 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38

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
Methylene Blue Cation SCHEMBL29474195 1.00 APP (0.55) APPTERTAPAF1EGFRPSMB5
Methylene Blue Cation SCHEMBL1351 1.00 APP (0.55) APPTERTAPAF1EGFRPSMB5
Methylene Blue Cation SCHEMBL1535728 0.98 APP (0.53) APPTERTAPAF1EGFRPSMB5
Methylene Blue Cation SCHEMBL31038651 0.98 APP (0.53) APPTERTAPAF1EGFRPSMB5
Methylene Blue Cation SCHEMBL1535732 0.98 APP (0.53) APPTERTAPAF1EGFRPSMB5
Methylene Blue Cation SCHEMBL1207311 0.98 APP (0.53) APPTERTAPAF1EGFRPSMB5
Methylene Blue Cation SCHEMBL1462448 0.98 APP (0.53) APPTERTAPAF1EGFRPSMB5
Methylene Blue Cation SCHEMBL12312491 0.98 APP (0.57) APPTERTAPAF1EGFRPSMB5
Methylene Blue Cation SCHEMBL109755 0.98 APP (0.57) APPTERTAPAF1EGFRPSMB5
Methylene Blue Cation SCHEMBL12312498 0.98 APP (0.57) APPTERTAPAF1EGFRPSMB5

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
US-20090297408-A1 Method for Formation of Alumina Coating Film, Alumina Fiber, and Gas Treatment System Comprising the Alumina Fiber TANAKA KENICHIRO 2009-12-03 US disclosed