Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.35 |
| ▸ | MC3R | P41968 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.35 |
| ▸ | GDA | Q9Y2T3 | 1/20 | 0.35 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL475287 | 0.83 | ADORA2B (0.37) | ADORA2BALDH1A1KDM4EALOX15POLB | |
| SCHEMBL9972908 | 0.81 | KMT2A (0.44) | ADORA2BALDH1A1KDM4EADORA2APIK3CD | |
| SCHEMBL1689535 | 0.73 | ADORA2B (0.40) | ADORA2BALDH1A1KDM4EALOX15ADORA2A | |
| SCHEMBL13190508 | 0.69 | ALOX15 (0.42) | ADORA2BALDH1A1KDM4EALOX15HPGD | |
| SCHEMBL1689509 | 0.68 | KDM4E (0.47) | ADORA2BALDH1A1KDM4EADORA2APIK3CD | |
| SCHEMBL9972885 | 0.68 | KDM4E (0.41) | ADORA2BALDH1A1KDM4EADORA2AHPGD | |
| SCHEMBL14972716 | 0.67 | KDM4E (0.36) | ADORA2BALDH1A1KDM4EADORA2APIK3CD | |
| SCHEMBL14981101 | 0.67 | ALDH1A1 (0.36) | ALDH1A1KDM4EALOX15POLBHPGD | |
| SCHEMBL27979275 | 0.66 | KMT2A (0.66) | ADORA2BALDH1A1ADORA2ARXFP1KMT2A | |
| SCHEMBL14981131 | 0.65 | TNF (0.44) | KDM4EALOX15POLBRXFP1LMNA |
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-2411397-B1 | ISOTHIAZOLO-PYRIMIDINEDIONE DERIVATIVES AS TRPA1 MODULATORS | GLENMARK PHARMACEUTICALS SA (CH) | 2013-05-29 | — | — | EP | disclosed |
| WO-2010109328-A1 | ISOTHIAZOLO-PYRIMIDINEDIONE DERIVATIVES AS TRPA1 MODULATORS | GLENMARK PHARMACEUTICALS, S.A. (CH) | 2010-09-30 | — | — | WO | disclosed |