Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.73 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.73 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.35 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.34 |
| ▸ | TUBB | P07437 | 2/20 | 0.34 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.34 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.34 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.34 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.34 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.34 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.34 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.34 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.34 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1957569 | 0.99 | ABCB1 (0.75) | ABCB1ABCG2PDE4BMEN1MAPT | |
| SCHEMBL1957568 | 0.99 | ABCB1 (0.75) | ABCB1ABCG2PDE4BMEN1MAPT | |
| SCHEMBL1959532 | 0.92 | ABCB1 (0.75) | ABCB1ABCG2PDE4BMEN1MAPT | |
| SCHEMBL1959534 | 0.92 | ABCB1 (0.75) | ABCB1ABCG2PDE4BMEN1MAPT | |
| SCHEMBL1960303 | 0.88 | ABCB1 (0.66) | ABCB1ABCG2PDE4BMEN1MAPT | |
| SCHEMBL1960302 | 0.88 | ABCB1 (0.66) | ABCB1ABCG2PDE4BMEN1MAPT | |
| SCHEMBL1960866 | 0.85 | ABCB1 (1.00) | ABCB1ABCG2PDE4BMEN1MAPT | |
| SCHEMBL1960865 | 0.85 | ABCB1 (1.00) | ABCB1ABCG2PDE4BMEN1MAPT | |
| SCHEMBL29398276 | 0.85 | ABCB1 (1.00) | ABCB1ABCG2PDE4BMEN1MAPT | |
| Hydrochloric Acid SCHEMBL1960471 | 0.84 | ABCB1 (0.98) | ABCB1ABCG2PDE4BMEN1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2332905-A1 | BCRP/ABCG3 Inhibitor | Kabushiki Kaisha Yakult Honsha (JP) | 2011-06-15 | — | — | EP | disclosed |
| EP-1864972-A1 | BCRP/ABCG2 INHIBITOR | Kabushiki Kaisha Yakult Honsha (JP) | 2007-12-12 | — | — | EP | disclosed |