Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CDC7 | O00311 | 1/20 | 0.33 |
| ▸ | PLK4 | O00444 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.33 |
| ▸ | CHUK | O15111 | 1/20 | 0.33 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.33 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1127247 | 0.79 | HTT (0.48) | ADRB2KDM4EL3MBTL1HTTALDH1A1 | |
| SCHEMBL1127088 | 0.72 | HTT (0.47) | ADRB2KDM4EL3MBTL1HTTALDH1A1 | |
| SCHEMBL1127206 | 0.71 | HTT (0.46) | ADRB2KDM4EL3MBTL1HTTALDH1A1 | |
| SCHEMBL5534778 | 0.70 | ALDH1A1 (0.47) | HTTALDH1A1RAB9APARP1SMN1; SMN2 | |
| SCHEMBL17800969 | 0.66 | CD274 (0.43) | ADRB2KDM4EL3MBTL1ALDH1A1RAB9A | |
| SCHEMBL1126705 | 0.66 | HTT (0.50) | ADRB2KDM4EHTTALDH1A1RAB9A | |
| SCHEMBL1127151 | 0.66 | HTT (0.43) | HTTALDH1A1PARP1CDC7PLK4 | |
| SCHEMBL28025320 | 0.65 | ADRB2 (0.39) | ADRB2KDM4EL3MBTL1HTTALDH1A1 | |
| SCHEMBL28451431 | 0.65 | HTT (0.45) | KDM4EHTTALDH1A1RAB9APARP1 | |
| SCHEMBL1126842 | 0.65 | HTT (0.42) | KDM4EHTTALDH1A1RAB9APARP1 |
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-2283006-A1 | PYRROLE ANTIFUNGAL AGENTS | F2G Limited (GB) | 2011-02-16 | — | — | EP | disclosed |
| WO-2009130481-A1 | PYRROLE ANTIFUNGAL AGENTS | F2G LTD (GB) | 2009-10-29 | — | — | WO | disclosed |