Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 7/20 | 0.68 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.65 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.65 |
| ▸ | CA12 | O43570 | 1/20 | 0.65 |
| ▸ | CA1 | P00915 | 1/20 | 0.65 |
| ▸ | CA2 | P00918 | 1/20 | 0.65 |
| ▸ | CA7 | P43166 | 1/20 | 0.65 |
| ▸ | CA9 | Q16790 | 1/20 | 0.65 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.65 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | APP | P05067 | 1/20 | 0.54 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.54 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL629952 | 0.96 | MAOB (0.74) | MAOBPDK2PDK4CA12CA1 | |
| SCHEMBL29717105 | 0.86 | MAOB (0.63) | MAOBCA12CA1CA2CA7 | |
| SCHEMBL710202 | 0.86 | MAOB (0.63) | MAOBCA12CA1CA2CA7 | |
| SCHEMBL7928394 | 0.85 | MAOB (0.59) | MAOBPDK2PDK4CA12CA1 | |
| SCHEMBL4212043 | 0.85 | MAOB (0.58) | MAOBPDK2PDK4CA12CA1 | |
| SCHEMBL15615390 | 0.85 | MAOB (0.58) | MAOBPDK2PDK4CA12CA1 | |
| SCHEMBL3962253 | 0.85 | MAOB (0.61) | MAOBLMNAHPGDNPC1 | |
| SCHEMBL5336493 | 0.84 | MAOB (0.61) | MAOBLMNAHPGDNPC1APP | |
| SCHEMBL29032428 | 0.84 | MAOB (0.58) | MAOBPDK2PDK4CA12CA1 | |
| SCHEMBL7901014 | 0.84 | MAOB (0.57) | MAOBPDK2PDK4CA12CA1 |
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-1817287-A1 | AROMATIC ETHER DERIVATIVES USEFUL AS THROMBIN INHIBITORS | Eli Lilly and Company (US) | 2007-08-15 | — | — | EP | disclosed |
| WO-2006057845-A1 | AROMATIC ETHER DERIVATIVES USEFUL AS THROMBIN INHIBITORS | ELI LILLY AND COMPANY (US) | 2006-06-01 | — | — | WO | disclosed |