Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | MAP4K4 | O95819 | 6/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 4/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL5572824 | 0.82 | KDM4E (0.43) | KDM4EMAP4K4KMT2AMEN1ALDH1A1 | |
| SCHEMBL4598347 | 0.82 | ALDH1A1 (0.50) | KDM4EMAP4K4KMT2AMEN1ALDH1A1 | |
| SCHEMBL5575305 | 0.81 | KDM4E (0.42) | KDM4EMAP4K4KMT2AMEN1ALDH1A1 | |
| SCHEMBL4140304 | 0.81 | KDM4E (0.46) | KDM4EMAP4K4KMT2AMEN1ALDH1A1 | |
| SCHEMBL4596118 | 0.80 | MAP4K4 (0.51) | KDM4EMAP4K4KMT2AMEN1LMNA | |
| SCHEMBL3980466 | 0.77 | TDP1 (0.44) | KDM4EMAP4K4KMT2AALDH1A1HPGD | |
| SCHEMBL3985523 | 0.77 | KDM4E (0.39) | KDM4EMAP4K4KMT2AMEN1ALDH1A1 | |
| SCHEMBL4598142 | 0.76 | MAPT (0.52) | KMT2AMEN1ALDH1A1HPGDHSD17B10 | |
| SCHEMBL13809841 | 0.76 | MAP4K4 (0.40) | KDM4EMAP4K4KMT2AMEN1ALDH1A1 | |
| SCHEMBL4597491 | 0.75 | ALDH1A1 (0.53) | KDM4EKMT2AALDH1A1L3MBTL1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009075960-A1 | CCR5 ANTAGONISTS AS THERAPEUTIC AGENTS | SMITHKLINE BEECHAM CORPORATION (US) | 2009-06-18 | — | — | WO | disclosed |