Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.33 |
| ▸ | CDK5R1 | Q15078 | 3/20 | 0.33 |
| ▸ | PDGFRB | P09619 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.33 |
| ▸ | CDK2 | P24941 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8633321 | 0.86 | MAPT (0.31) | ADORA1MAPTALDH1A1MEN1KMT2A | |
| SCHEMBL8990377 | 0.82 | ADORA1 (0.40) | ADORA1SMN1; SMN2POLBMAPTALDH1A1 | |
| SCHEMBL8990371 | 0.82 | ADORA1 (0.40) | ADORA1SMN1; SMN2POLBMAPTALDH1A1 | |
| SCHEMBL8637305 | 0.75 | USP2 (0.38) | ADORA1SMN1; SMN2POLBMAPTALDH1A1 | |
| Ethylene SCHEMBL8636375 | 0.69 | USP2 (0.48) | ADORA1SMN1; SMN2POLBALDH1A1MEN1 | |
| SCHEMBL8990359 | 0.68 | KDR (0.36) | ADORA1MEN1KMT2APDGFRBKDR | |
| SCHEMBL6651265 | 0.61 | ADORA1 (0.48) | ADORA1SMN1; SMN2POLBMAPTALDH1A1 | |
| SCHEMBL8633481 | 0.61 | BCHE (0.32) | SMN1; SMN2NPC1RAB9A | |
| SCHEMBL8633484 | 0.61 | BCHE (0.32) | SMN1; SMN2NPC1RAB9A | |
| SCHEMBL14840612 | 0.60 | GRM5 (0.57) | ADORA1POLBKDM4EMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5712281-A | Insecticidal substituted-2,4-diamino-5,6,7,8-tetrahydroquinazolines | FMC CORPORATION (US) | 1998-01-27 | — | — | US | disclosed |