Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. 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 | |
|---|---|---|---|---|
| ▸ | CHAT | P28329 | 4/20 | 0.56 |
| ▸ | PKM | P14618 | 4/20 | 0.55 |
| ▸ | HTT | P42858 | 3/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.55 |
| ▸ | RAB9A | P51151 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.55 |
| ▸ | NSD2 | O96028 | 2/20 | 0.55 |
| ▸ | POLB | P06746 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.55 |
| ▸ | RAD52 | P43351 | 3/20 | 0.52 |
| ▸ | APP | P05067 | 6/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9393622 | 0.89 | CHAT (0.56) | CHATPKMHTTNPSR1SMN1; SMN2 | |
| SCHEMBL5157891 | 0.86 | CHAT (0.61) | CHATPKMHTTNPSR1SMN1; SMN2 | |
| SCHEMBL10347865 | 0.81 | CHAT (0.51) | CHATPKMHTTNPSR1SMN1; SMN2 | |
| SCHEMBL6554349 | 0.77 | CHAT (0.49) | CHATPKMHTTNPSR1SMN1; SMN2 | |
| SCHEMBL4626049 | 0.74 | CHAT (0.77) | CHATPKMHTTNPSR1SMN1; SMN2 | |
| SCHEMBL4626052 | 0.74 | CHAT (0.77) | CHATPKMHTTNPSR1SMN1; SMN2 | |
| Ethylene Glycol SCHEMBL16144034 | 0.73 | CHAT (0.66) | CHATPKMHTTNPSR1SMN1; SMN2 | |
| SCHEMBL13766059 | 0.73 | CHAT (0.79) | CHATPKMHTTNPSR1SMN1; SMN2 | |
| SCHEMBL14700346 | 0.72 | CHAT (0.77) | CHATPKMHTTNPSR1SMN1; SMN2 | |
| SCHEMBL1245826 | 0.72 | CHAT (0.77) | CHATPKMHTTNPSR1SMN1; SMN2 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5334485-A | Containing n-heterocyclic ring | THE CHROMALINE CORPORATION (US) | 1994-08-02 | — | — | US | disclosed |