Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.30 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.30 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.30 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.30 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.30 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.30 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.30 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.30 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.30 |
| ▸ | G6PC1 | P35575 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7573127 | 0.86 | CA2 (0.33) | — | |
| SCHEMBL7573124 | 0.86 | CA2 (0.33) | — | |
| SCHEMBL7579771 | 0.81 | MAPT (0.40) | MAOBGRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL7573394 | 0.78 | GRIN2D (0.33) | CYP1A2GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL7575258 | 0.74 | G6PC1 (0.35) | ADORA1G6PC1 | |
| SCHEMBL7575256 | 0.74 | G6PC1 (0.35) | ADORA1G6PC1 | |
| SCHEMBL7571802 | 0.73 | G6PC1 (0.36) | MAOBCYP1A2TSHRGRIN2DGRIN3B | |
| SCHEMBL7579060 | 0.72 | G6PC1 (0.43) | MAOBCYP1A2GRIN1GRIN2BG6PC1 | |
| SCHEMBL7579055 | 0.72 | G6PC1 (0.43) | MAOBCYP1A2GRIN1GRIN2BG6PC1 | |
| SCHEMBL7575202 | 0.71 | MAOB (0.44) | MAOBCYP1A2TSHRADORA2AADORA1 |
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 |