Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1 | Q15116 | 2/20 | 0.38 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.38 |
| ▸ | DPP4 | P27487 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | BLM | P54132 | 1/20 | 0.30 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14930366 | 0.87 | DPP4 (0.36) | PDCD1CD274DPP4CYP3A4 | |
| SCHEMBL8181509 | 0.72 | DPP4 (0.58) | PDCD1CD274DPP4KCNH2 | |
| SCHEMBL14549685 | 0.72 | DPP4 (0.58) | PDCD1CD274DPP4KCNH2 | |
| SCHEMBL12706687 | 0.71 | CYP3A4 (0.32) | CYP3A4TSHRHSD17B10LMNABLM | |
| SCHEMBL9963385 | 0.71 | ADORA2A (0.38) | CYP3A4TSHRHSD17B10LMNABLM | |
| SCHEMBL6369625 | 0.71 | CYP3A4 (0.53) | CYP3A4TSHRHSD17B10DRD2KCNH2 | |
| SCHEMBL14970359 | 0.69 | NOTUM (0.39) | KCNH2 | |
| SCHEMBL24585187 | 0.68 | CYP3A4 (0.45) | CYP3A4TSHRHSD17B10LMNABLM | |
| SCHEMBL12765092 | 0.66 | DPP4 (0.33) | DPP4 | |
| SCHEMBL14908332 | 0.65 | ALDH1A1 (0.41) | TSHRHSD17B10LMNA |
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-2426135-A1 | UREA DERIVATIVE HAVING PI3K INHIBITORY ACTIVITY | Shionogi&Co., Ltd. (JP) | 2012-03-07 | — | — | EP | disclosed |