Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 6/20 | 0.37 |
| ▸ | NOS2 | P35228 | 6/20 | 0.37 |
| ▸ | MGMT | P16455 | 3/20 | 0.37 |
| ▸ | NOS1 | P29475 | 3/20 | 0.34 |
| ▸ | NCF1 | P14598 | 2/20 | 0.34 |
| ▸ | F12 | P00748 | 1/20 | 0.34 |
| ▸ | PLAU | P00749 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 3/20 | 0.34 |
| ▸ | CDK1 | P06493 | 2/20 | 0.34 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.34 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.34 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CASP6 | P55212 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CDK4 | P11802 | 1/20 | 0.32 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19345071 | 0.78 | MGMT (0.35) | NOS3NOS2MGMTNOS1NCF1 | |
| SCHEMBL12503575 | 0.78 | MGMT (0.35) | NOS3NOS2MGMTNOS1NCF1 | |
| SCHEMBL12528205 | 0.78 | NOS2 (0.54) | NOS3NOS2MGMTNOS1NCF1 | |
| SCHEMBL13911701 | 0.78 | NR4A2 (0.36) | MGMTNCF1MAPTGAANR4A2 | |
| SCHEMBL19363563 | 0.78 | NCF1 (0.32) | MGMTNCF1MAPT | |
| SCHEMBL19216519 | 0.78 | MAPT (0.41) | NOS3NOS2MGMTNOS1NCF1 | |
| SCHEMBL11446549 | 0.77 | NOS2 (0.37) | NOS3NOS2NOS1NCF1F12 | |
| SCHEMBL5278996 | 0.72 | THRB (0.38) | CDK2CDK1MAPTKDM4EMEN1 | |
| SCHEMBL2491871 | 0.70 | CDK2 (0.37) | MGMTCDK2CDK1CCNA2CCNA1 | |
| SCHEMBL5310168 | 0.70 | MAPT (0.50) | CDK2MAPTKDM4EMEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0225614-A2 | Process for the preparation of 4-substituted 5-nitroso-4,6-diamino-pyrimidines | LONZA AG (CH) | 1987-06-16 | — | — | EP | disclosed |