Known targets — ChEMBL curated mechanism
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)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 5/20 | 0.55 |
| ▸ | TERT | O14746 | 1/20 | 0.55 |
| ▸ | APAF1 | O14727 | 2/20 | 0.46 |
| ▸ | EGFR | P00533 | 2/20 | 0.44 |
| ▸ | PSMB5 | P28074 | 5/20 | 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 |
| ▸ | ELANE | P08246 | 1/20 | 0.38 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.38 |
| ▸ | INSR | P06213 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | RECQL | P46063 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Methylene Blue Cation SCHEMBL1462448 | 0.98 | APP (0.53) | APPTERTAPAF1EGFRPSMB5 | |
| Methylene Blue Cation SCHEMBL31038651 | 0.98 | APP (0.53) | APPTERTAPAF1EGFRPSMB5 | |
| Methylene Blue Cation SCHEMBL1535728 | 0.98 | APP (0.53) | APPTERTAPAF1EGFRPSMB5 | |
| Methylene Blue Cation SCHEMBL1207311 | 0.98 | APP (0.53) | APPTERTAPAF1EGFRPSMB5 | |
| Methylene Blue Cation SCHEMBL1535732 | 0.98 | APP (0.53) | APPTERTAPAF1EGFRPSMB5 | |
| Methylene Blue Cation SCHEMBL12312491 | 0.98 | APP (0.57) | APPTERTAPAF1EGFRPSMB5 | |
| Methylene Blue Cation SCHEMBL12312497 | 0.98 | APP (0.57) | APPTERTAPAF1EGFRPSMB5 | |
| Methylene Blue Cation SCHEMBL12312498 | 0.98 | APP (0.57) | APPTERTAPAF1EGFRPSMB5 | |
| Methylene Blue Cation SCHEMBL29941578 | 0.98 | APP (0.57) | APPTERTAPAF1EGFRPSMB5 | |
| Methylene Blue Cation SCHEMBL109755 | 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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2480540-B1 | METHYLTHIONINIUM CHLORIDE PENTAHYDRATE, PREPARATION AND PHARMACEUTICAL USE THEREOF | WISTA LAB LTD (SG) | 2017-11-29 | — | — | EP | disclosed |
| US-8901296-B2 | Process for the preparation of substantially pure methylthionium chloride pentahydrate form A | WISTA LABORATORIES LTD. (SG) | 2014-12-02 | — | — | US | disclosed |
| US-20120289499-A1 | PROCESS | WISTA LABORATORIES LTD. | 2012-11-15 | — | — | US | disclosed |
| EP-2480540-A2 | PROCESS | Wista Laboratories Ltd. (SG) | 2012-08-01 | — | — | EP | disclosed |
| WO-2011036561-A2 | PROCESS | Wis Ta Laboratories Ltd. (SG) | 2011-03-31 | — | — | WO | disclosed |