Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | POLB | P06746 | 3/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.52 |
| ▸ | GPR183 | P32249 | 5/20 | 0.47 |
| ▸ | ME2 | P23368 | 1/20 | 0.47 |
| ▸ | ME1 | P48163 | 1/20 | 0.47 |
| ▸ | ME3 | Q16798 | 1/20 | 0.47 |
| ▸ | AR | P10275 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL2904853 | 1.00 | MEN1 (0.58) | MEN1KMT2APOLBALDH1A1MAPT | |
| SCHEMBL2896736 | 0.92 | MEN1 (0.54) | MEN1KMT2APOLBALDH1A1MAPT | |
| SCHEMBL2896739 | 0.92 | MEN1 (0.54) | MEN1KMT2APOLBALDH1A1MAPT | |
| SCHEMBL2905291 | 0.89 | GAA (0.57) | MEN1KMT2AALDH1A1MAPTRAB9A | |
| SCHEMBL2902873 | 0.89 | ALDH1A1 (0.60) | MEN1KMT2AALDH1A1RAB9AGPR183 | |
| SCHEMBL2902877 | 0.89 | ALDH1A1 (0.60) | MEN1KMT2AALDH1A1RAB9AGPR183 | |
| SCHEMBL2905287 | 0.89 | GAA (0.57) | MEN1KMT2AALDH1A1MAPTRAB9A | |
| SCHEMBL2904334 | 0.88 | MEN1 (0.51) | MEN1KMT2AALDH1A1MAPTGPR183 | |
| SCHEMBL2904336 | 0.88 | MEN1 (0.51) | MEN1KMT2AALDH1A1MAPTGPR183 | |
| SCHEMBL2897056 | 0.87 | MEN1 (0.51) | MEN1KMT2AALDH1A1RAB9AGPR183 |
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 |