Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 5/20 | 0.57 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.57 |
| ▸ | KDR | P35968 | 2/20 | 0.43 |
| ▸ | CDK2 | P24941 | 4/20 | 0.42 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.42 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TDO2 | P48775 | 3/20 | 0.40 |
| ▸ | IDO1 | P14902 | 2/20 | 0.40 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.40 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.40 |
| ▸ | CDK1 | P06493 | 2/20 | 0.39 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.39 |
| ▸ | AURKA | O14965 | 2/20 | 0.39 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2565558 | 0.73 | ROCK2 (1.00) | ROCK2ROCK1KDRCDK2CDK1 | |
| SCHEMBL11577130 | 0.71 | MAPKAPK2 (0.35) | ROCK2ROCK1TDO2IDO1LRRK2 | |
| SCHEMBL14045319 | 0.70 | ROCK2 (0.77) | ROCK2ROCK1LMNAKDM4EMEN1 | |
| SCHEMBL2571902 | 0.70 | ROCK1 (0.44) | ROCK2ROCK1LRRK2AURKBAURKA | |
| SCHEMBL8765742 | 0.68 | LMNA (0.61) | LMNAMEN1NPC1MAPTRAB9A | |
| SCHEMBL28485570 | 0.68 | LMNA (0.56) | LMNAMEN1NPC1MAPTRAB9A | |
| SCHEMBL8765733 | 0.68 | LMNA (0.56) | LMNAKDM4EMEN1NPC1MAPT | |
| SCHEMBL6156902 | 0.67 | CDK2 (0.49) | ROCK2ROCK1KDRCDK2CCNA2 | |
| SCHEMBL4472795 | 0.66 | LMNA (0.54) | LMNAKDM4EMEN1NPC1MAPT | |
| SCHEMBL3071609 | 0.66 | LMNA (0.71) | LMNAGLAKDM4EMEN1NPC1 |
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-4096333-A | NITROSATION OF A 2-METHYLACETANILIDE | TENNECO CHEMICALS, INC. (US) | 1978-06-20 | — | — | US | disclosed |
| US-3988347-A | NITROSATION OF A 2-METHYL-ACETANILIDE WITH SODIUM NITRITE | TENNECO CHEMICALS, INC. (US) | 1976-10-26 | — | — | US | disclosed |