Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 4/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | SYK | P43405 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | AKT1 | P31749 | 2/20 | 0.38 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | CTSS | P25774 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2894833 | 0.82 | NPC1 (0.50) | CYP2C9PTGER1BRD4NPC1RAB9A | |
| SCHEMBL2889547 | 0.80 | CYP2C9 (0.47) | CYP2C9PTGER1BRD4NPC1SYK | |
| SCHEMBL7342794 | 0.75 | BRD4 (0.68) | CYP2C9PTGER1BRD4NPC1SYK | |
| SCHEMBL31088840 | 0.73 | PTGER1 (0.49) | CYP2C9PTGER1BRD4SMN1; SMN2AKT1 | |
| SCHEMBL11959262 | 0.71 | BRD4 (0.51) | CYP2C9PTGER1BRD4NPC1RAB9A | |
| SCHEMBL30705048 | 0.71 | BRD4 (0.54) | CYP2C9PTGER1BRD4NPC1SYK | |
| SCHEMBL6279532 | 0.71 | BRD4 (0.48) | CYP2C9PTGER1BRD4NPC1SYK | |
| SCHEMBL23970799 | 0.71 | CYP2C9 (0.50) | CYP2C9PTGER1BRD4NPC1RAB9A | |
| SCHEMBL30159014 | 0.71 | CYP2C9 (0.50) | CYP2C9PTGER1BRD4NPC1RAB9A | |
| SCHEMBL3000336 | 0.71 | PTGER1 (0.44) | CYP2C9PTGER1BRD4NPC1SYK |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2003076443-A9 | SPIRO COMPOUNDS WITH NPY ANTAGONISTIC ACTIVITY | BANYU PHARMA CO LTD (JP) | 2005-01-20 | — | — | WO | disclosed |
| EP-1483266-A1 | SPIRO COMPOUNDS WITH NPY ANTAGONISTIC ACTIVITY | BANYU PHARMACEUTICAL CO., LTD. (JP) | 2004-12-08 | — | — | EP | disclosed |
| WO-2003076443-A1 | SPIRO COMPOUNDS WITH NPY ANTAGONISTIC ACTIVITY | BANYU PHARMACEUTICAL CO., LTD. (JP) | 2003-09-18 | — | — | WO | disclosed |