Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 3/20 | 0.39 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.36 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.35 |
| ▸ | RORB | Q92753 | 1/20 | 0.35 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.35 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL6325332 | 0.83 | ALDH1A1 (0.45) | TP53SOS1ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL6322928 | 0.75 | TP53 (0.44) | TP53SOS1ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL6322936 | 0.75 | TP53 (0.44) | TP53SOS1ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL6325337 | 0.73 | SOS1 (0.41) | TP53SOS1ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL6325308 | 0.69 | TP53 (0.46) | TP53SOS1 | |
| SCHEMBL6325311 | 0.69 | TP53 (0.46) | TP53SOS1 | |
| SCHEMBL27649028 | 0.67 | SOS1 (0.57) | SOS1ALDH1A1SMN1; SMN2NPC1HPGD | |
| SCHEMBL14947249 | 0.67 | NR4A1 (0.39) | TP53POLB | |
| SCHEMBL9890685 | 0.66 | PTGS2 (0.53) | HPGDCXCL8PDE4BPTGS2LMNA | |
| SCHEMBL6400955 | 0.66 | SOS1 (0.60) | TP53SOS1ALDH1A1SMN1; SMN2NPC1 |
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-6887877-B2 | Compounds and methods for the treatment or prevention of Flavivirus infections | VIROCHEM PHARMA INC. (CA) | 2005-05-03 | — | — | US | claimed |