Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | AKT1 | P31749 | 3/20 | 0.42 |
| ▸ | BACE1 | P56817 | 3/20 | 0.42 |
| ▸ | CTSS | P25774 | 4/20 | 0.41 |
| ▸ | CTSL | P07711 | 2/20 | 0.41 |
| ▸ | CTSB | P07858 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.40 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.40 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.39 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.39 |
| ▸ | PTGES | O14684 | 1/20 | 0.39 |
| ▸ | SYK | P43405 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2177713 | 0.94 | BACE1 (0.44) | IDO1AKT1BACE1CTSSCTSL | |
| SCHEMBL2158118 | 0.90 | SIGMAR1 (0.43) | IDO1BACE1CTSSCTSLCTSB | |
| SCHEMBL2821039 | 0.85 | GPR88 (0.39) | IDO1BACE1CTSSITGB1ITGA4 | |
| SCHEMBL2818137 | 0.85 | L3MBTL1 (0.46) | IDO1BACE1CTSSHTTSYK | |
| SCHEMBL2797442 | 0.84 | EPHX1 (0.36) | CTSSNR1H4MEN1KMT2ACTSK | |
| SCHEMBL614479 | 0.83 | CTSK (0.47) | IDO1CTSSCTSLCTSBSYK | |
| SCHEMBL1521024 | 0.81 | RIPK1 (0.53) | IDO1CTSSSYKMEN1KMT2A | |
| SCHEMBL16084764 | 0.81 | RIPK1 (0.53) | IDO1CTSSSYKMEN1KMT2A | |
| SCHEMBL2176308 | 0.81 | L3MBTL1 (0.50) | IDO1BACE1CTSSHTTSYK | |
| SCHEMBL2179437 | 0.79 | ITGB1 (0.40) | BACE1ITGB1ITGA4MEN1KMT2A |
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-2340242-A2 | COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS | Acucela, Inc. (US) | 2011-07-06 | — | — | EP | disclosed |
| WO-2010048332-A2 | COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS | ACUCELA, INC. (US) | 2010-04-29 | — | — | WO | disclosed |