Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 1/20 | 0.32 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.31 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.31 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.30 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.30 |
| ▸ | CDK2 | P24941 | 1/20 | 0.30 |
| ▸ | CDK9 | P50750 | 1/20 | 0.30 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.30 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.30 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.30 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3372661 | 0.84 | MAPT (0.44) | CDK9CDK5ALDH1A1MAPTHPGD | |
| SCHEMBL3375305 | 0.84 | MAPT (0.44) | CDK9CDK5ALDH1A1MAPTHPGD | |
| SCHEMBL3371078 | 0.76 | CCR1 (0.41) | MCHR1GRIN3BGRIN1GRIN2CCCNT1 | |
| SCHEMBL3373060 | 0.75 | MAPT (0.35) | GRIN3BGRIN1GRIN2CALDH1A1MAPT | |
| SCHEMBL27718867 | 0.72 | IRAK4 (0.32) | GRIN3BGRIN1GRIN2CIRAK4 | |
| SCHEMBL3371468 | 0.72 | KDM4E (0.34) | ALDH1A1MAPTHPGD | |
| SCHEMBL3370325 | 0.70 | ALDH1A1 (0.34) | CCNT1CCNA2CDK2CDK9CDK5 | |
| SCHEMBL3374050 | 0.70 | ALDH1A1 (0.36) | ALDH1A1MAPTHPGDSMN1; SMN2 | |
| SCHEMBL14337697 | 0.70 | MKNK2 (0.35) | ALDH1A1MAPTHPGDSMN1; SMN2 | |
| SCHEMBL3375285 | 0.70 | ALDH1A1 (0.36) | ALDH1A1MAPTHPGDSMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1869036-B1 | SUBSTITUTED 1,5-NAPHTHYRIDINE AZOLIDINONES AS CDK INHIBITORS | HOFFMANN LA ROCHE (CH) | 2010-11-03 | — | — | EP | disclosed |