Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K4 | O95819 | 8/20 | 0.65 |
| ▸ | LMNA | P02545 | 4/20 | 0.49 |
| ▸ | BRAF | P15056 | 3/20 | 0.49 |
| ▸ | RAF1 | P04049 | 2/20 | 0.49 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.49 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.49 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.49 |
| ▸ | MTOR | P42345 | 1/20 | 0.49 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.48 |
| ▸ | CLK4 | Q9HAZ1 | 5/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | USP2 | O75604 | 2/20 | 0.48 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL22744963 | 0.87 | MAP4K4 (0.51) | MAP4K4LMNACYP1A2CYP3A4CLK4 | |
| SCHEMBL14216189 | 0.84 | LMNA (0.46) | MAP4K4LMNACYP1A2CYP3A4CLK4 | |
| SCHEMBL14189299 | 0.84 | MAP4K4 (0.66) | MAP4K4LMNABRAFRAF1PIK3CA | |
| SCHEMBL14189305 | 0.83 | MAP4K4 (0.68) | MAP4K4LMNABRAFRAF1CLK4 | |
| SCHEMBL14189294 | 0.81 | LMNA (0.44) | MAP4K4LMNACYP1A2CYP3A4CLK4 | |
| SCHEMBL14189300 | 0.81 | MAP4K4 (0.70) | MAP4K4LMNABRAFRAF1PIK3CA | |
| SCHEMBL14189297 | 0.81 | LMNA (0.44) | MAP4K4LMNACYP1A2CYP3A4CLK4 | |
| SCHEMBL14189303 | 0.81 | CYP1A2 (0.72) | LMNABRAFRAF1CYP1A2CYP3A4 | |
| SCHEMBL14189296 | 0.81 | MAP4K4 (0.50) | MAP4K4LMNACYP1A2CYP3A4CLK4 | |
| SCHEMBL14189298 | 0.81 | MAP4K4 (0.72) | MAP4K4LMNABRAFRAF1CYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7378409-B2 | Substituted cycloalkylamine derivatives as modulators of chemokine receptor activity | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-05-27 | — | — | US | disclosed |
| US-7378409-B2 | Substituted cycloalkylamine derivatives as modulators of chemokine receptor activity | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-05-27 | — | — | US | disclosed |