Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.41 |
| ▸ | NOS1 | P29475 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.41 |
| ▸ | C3AR1 | Q16581 | 5/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | KCNQ2 | O43526 | 2/20 | 0.34 |
| ▸ | RIOK2 | Q9BVS4 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10936719 | 1.00 | NOS3 (0.41) | NOS3NOS1NOS2C3AR1MAPT | |
| SCHEMBL11225317 | 0.85 | GPR3 (0.40) | C3AR1L3MBTL1 | |
| SCHEMBL11204045 | 0.80 | C3AR1 (0.35) | C3AR1 | |
| SCHEMBL11204044 | 0.80 | C3AR1 (0.35) | C3AR1 | |
| SCHEMBL11206844 | 0.80 | PLAU (0.45) | NOS3NOS1NOS2C3AR1MAPT | |
| SCHEMBL31130657 | 0.80 | PLAU (0.45) | NOS3NOS1NOS2C3AR1MAPT | |
| SCHEMBL10708780 | 0.80 | PLAU (0.45) | NOS3NOS1NOS2C3AR1MAPT | |
| SCHEMBL10710201 | 0.76 | NPC1 (0.39) | C3AR1ALDH1A1NPC1RAB9AL3MBTL1 | |
| SCHEMBL10991959 | 0.76 | NPC1 (0.39) | C3AR1ALDH1A1NPC1RAB9AL3MBTL1 | |
| SCHEMBL31493860 | 0.73 | HSD17B10 (0.44) | NOS3NOS1NOS2MAPTSMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4503257-A | MANGANESE DIOXIDE OR TRIIRON TETROXIDE CATALYST | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1985-03-05 | — | — | US | disclosed |
| US-4499305-A | FORMING STABLE DISPERSIONS OF A TRANSITION METAL COMPLEX AND 1,3-BIS/2-PYRIDYLIMINO/ISOINDOLINE IN CYCLOHEXANOL, CYCLOHEXANONE AND/OR CYCLOHEXANE | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1985-02-12 | — | — | US | disclosed |