Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM5 | P08912 | 1/20 | 0.53 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.47 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.47 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.47 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.47 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.47 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.47 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 5/20 | 0.39 |
| ▸ | RAB9A | P51151 | 4/20 | 0.39 |
| ▸ | CHAT | P28329 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7572612 | 1.00 | CHRM5 (0.53) | CHRM5GRIN1GRIN2BGRIN2DGRIN3B | |
| SCHEMBL7580565 | 0.86 | CHRM5 (0.51) | CHRM5GRIN1GRIN2BGRIN2DGRIN3B | |
| SCHEMBL7580562 | 0.86 | CHRM5 (0.51) | CHRM5GRIN1GRIN2BGRIN2DGRIN3B | |
| SCHEMBL7574938 | 0.83 | CHRM5 (0.49) | CHRM5GRIN1GRIN2BGRIN2DGRIN3B | |
| SCHEMBL7574932 | 0.83 | CHRM5 (0.49) | CHRM5GRIN1GRIN2BGRIN2DGRIN3B | |
| SCHEMBL7579687 | 0.82 | NPC1 (0.55) | MAPTKMT2AMEN1CYP1A2SMN1; SMN2 | |
| SCHEMBL7579680 | 0.82 | NPC1 (0.55) | MAPTKMT2AMEN1CYP1A2SMN1; SMN2 | |
| SCHEMBL7571671 | 0.81 | CHRM5 (0.50) | CHRM5GRIN1GRIN2BGRIN2DGRIN3B | |
| SCHEMBL7571676 | 0.81 | CHRM5 (0.50) | CHRM5GRIN1GRIN2BGRIN2DGRIN3B | |
| SCHEMBL7580436 | 0.81 | CHRM5 (0.46) | CHRM5GRIN1GRIN2BGRIN2DGRIN3B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0810199-B1 | Method for producing propargylamine compounds | SUMITOMO CHEMICAL CO (JP) | 2002-09-25 | — | — | EP | disclosed |
| US-5756769-A | Method for producing propargylamine compounds | SUMITOMO CHEMICAL COMPANY, LTD. (JP) | 1998-05-26 | — | — | US | disclosed |
| EP-0810199-A1 | Method for producing propargylamine compounds | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1997-12-03 | — | — | EP | disclosed |