Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 2/20 | 0.50 |
| ▸ | NOS1 | P29475 | 2/20 | 0.50 |
| ▸ | NOS2 | P35228 | 2/20 | 0.50 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.50 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.50 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.50 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.50 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.50 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.50 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | ESR1 | P03372 | 2/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA4 | P22748 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30416262 | 1.00 | NOS3 (0.50) | NOS3NOS1NOS2GRIN2DGRIN3B | |
| SCHEMBL16098463 | 0.90 | ALDH1A1 (0.56) | NOS3NOS1NOS2GRIN2DGRIN3B | |
| SCHEMBL16096960 | 0.87 | ALDH1A1 (0.44) | NOS3NOS1NOS2GRIN2DGRIN3B | |
| SCHEMBL16098066 | 0.86 | HTT (0.41) | NOS3NOS1NOS2GRIN2DGRIN3B | |
| SCHEMBL16096483 | 0.86 | CYP1A1 (0.50) | GRIN2DGRIN3BGRIN1GRIN2AGRIN2B | |
| SCHEMBL16098113 | 0.86 | HTT (0.41) | NOS3NOS1NOS2GRIN2DGRIN3B | |
| SCHEMBL16097131 | 0.85 | SMN1; SMN2 (0.45) | NOS3NOS1NOS2GRIN2DGRIN3B | |
| SCHEMBL15136502 | 0.83 | ALDH1A1 (0.51) | NOS3NOS1NOS2GRIN2DGRIN3B | |
| SCHEMBL15136503 | 0.83 | ALDH1A1 (0.51) | NOS3NOS1NOS2GRIN2DGRIN3B | |
| SCHEMBL15003926 | 0.83 | ALDH1A1 (0.51) | NOS3NOS1NOS2GRIN2DGRIN3B |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1100774-B1 | IMPROVED ARYLAMINE SYNTHESIS | MASSACHUSETTS INST TECHNOLOGY (US) | 2004-01-21 | — | — | EP | disclosed |
| US-6323366-B1 | ACTIVATED ARYL GROUP AND AN IMINE GROUP ARE COMBINED, IN THE PRESENCE OF A TRANSITION METAL CATALYST FOR FORMATION OF A CARBON-NITROGEN BOND BETWEEN THE ACTIVATED CARBON OF THE ARENE AND IMINE NITROGEN; CONVERTING TO ARYLAMINE | MASSACHUSETTS INSTITUTE OF TECHNOLOGY | 2001-11-27 | — | — | US | disclosed |
| EP-1100774-A1 | IMPROVED ARYLAMINE SYNTHESIS | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2001-05-23 | — | — | EP | disclosed |
| WO-2000005199-A1 | IMPROVED ARYLAMINE SYNTHESIS | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2000-02-03 | — | — | WO | disclosed |