Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 4/20 | 0.39 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.37 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.37 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | JAK1 | P23458 | 1/20 | 0.34 |
| ▸ | JAK3 | P52333 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6029095 | 0.94 | CHEK1 (0.39) | CHEK1PDPK1RPS6KB1GRIN1GRIN2B | |
| SCHEMBL6028207 | 0.93 | CHEK1 (0.39) | CHEK1PDPK1RPS6KB1GRIN1GRIN2B | |
| SCHEMBL6028842 | 0.93 | CHEK1 (0.39) | CHEK1PDPK1RPS6KB1GRIN1GRIN2B | |
| SCHEMBL6028518 | 0.91 | CHEK1 (0.39) | CHEK1POLBMAPTLMNASMN1; SMN2 | |
| SCHEMBL6029187 | 0.91 | MAPT (0.38) | CHEK1PDPK1RPS6KB1GRIN1GRIN2B | |
| SCHEMBL6028919 | 0.90 | CHEK1 (0.39) | CHEK1JAK1JAK3 | |
| SCHEMBL7819214 | 0.89 | AKT1 (0.42) | GRIN1GRIN2BTP53MAPTALDH1A1 | |
| Hydrochloric Acid SCHEMBL7830259 | 0.88 | AKT1 (0.41) | GRIN1GRIN2BTP53MAPTALDH1A1 | |
| SCHEMBL6029438 | 0.86 | CHEK1 (0.39) | CHEK1GRIN1GRIN2BTP53POLB | |
| SCHEMBL6030080 | 0.85 | MCHR1 (0.44) | TP53POLBMAPTALDH1A1LMNA |
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-6984643-B2 | 2,5-substituted pyrimidine derivatives-CCR-3 receptor antagonists | ROCHE PALO ALTO LLC (US) | 2006-01-10 | — | — | US | disclosed |