Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 4/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | ITGB2 | P05107 | 4/20 | 0.42 |
| ▸ | ICAM1 | P05362 | 4/20 | 0.42 |
| ▸ | ITGAL | P20701 | 4/20 | 0.42 |
| ▸ | GPR183 | P32249 | 2/20 | 0.42 |
| ▸ | CCR1 | P32246 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | F2R | P25116 | 1/20 | 0.40 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2903699 | 1.00 | RAB9A (0.58) | RAB9AALDH1A1SMN1; SMN2GAALMNA | |
| SCHEMBL2905287 | 0.85 | GAA (0.57) | RAB9AALDH1A1GAALMNAL3MBTL1 | |
| SCHEMBL2905291 | 0.85 | GAA (0.57) | RAB9AALDH1A1GAALMNAL3MBTL1 | |
| SCHEMBL2904334 | 0.84 | MEN1 (0.51) | ALDH1A1GAALMNAL3MBTL1MAPT | |
| SCHEMBL2904336 | 0.84 | MEN1 (0.51) | ALDH1A1GAALMNAL3MBTL1MAPT | |
| SCHEMBL2903391 | 0.82 | NPC1 (0.57) | RAB9ANPC1GPR183 | |
| SCHEMBL2903396 | 0.82 | NPC1 (0.57) | RAB9ANPC1GPR183 | |
| SCHEMBL2905043 | 0.82 | APP (0.47) | RAB9AALDH1A1LMNAITGALGPR183 | |
| SCHEMBL2905040 | 0.82 | APP (0.47) | RAB9AALDH1A1LMNAITGALGPR183 | |
| SCHEMBL2897317 | 0.82 | NPC1 (0.56) | RAB9ANPC1GPR183 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2010506-B1 | DIAZEPAN DERIVATIVES MODULATORS OF CHEMOKINE RECEPTORS | HOFFMANN LA ROCHE (CH) | 2010-08-04 | — | — | EP | disclosed |