Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.44 |
| ▸ | MAPT | P10636 | 5/20 | 0.39 |
| ▸ | GAA | P10253 | 4/20 | 0.39 |
| ▸ | CASP1 | P29466 | 4/20 | 0.39 |
| ▸ | CASP7 | P55210 | 4/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.36 |
| ▸ | BAZ2A | Q9UIF9 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1127446 | 0.84 | MIF (0.38) | ALDH1A1KDM4EMAPTGAAHPGD | |
| SCHEMBL1127046 | 0.81 | CNR1 (0.46) | ALDH1A1KDM4EGAAHPGDLMNA | |
| SCHEMBL1126908 | 0.79 | ALDH1A1 (0.38) | ALDH1A1KDM4EMAPTGAAHPGD | |
| SCHEMBL15162449 | 0.78 | ALDH1A1 (0.42) | ALDH1A1KDM4ECASP1CASP7HSD17B10 | |
| SCHEMBL1126989 | 0.76 | ALDH1A1 (0.39) | ALDH1A1CASP1HSD17B10HPGDCYP1A2 | |
| SCHEMBL1126629 | 0.73 | ACACB (0.37) | ALDH1A1KDM4EMAPTGAACASP1 | |
| SCHEMBL1126978 | 0.71 | ACACB (0.38) | ALDH1A1KDM4EGAAHSD17B10HPGD | |
| SCHEMBL1127037 | 0.70 | BAZ2B (0.40) | ALDH1A1KDM4EMAPTGAAHSD17B10 | |
| SCHEMBL15162079 | 0.69 | ALDH1A1 (0.32) | ALDH1A1KDM4EGAACASP1CASP7 | |
| SCHEMBL1127685 | 0.68 | POLB (0.39) | ALDH1A1KDM4EMAPTHSD17B10HPGD |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2626361-B1 | Pyrrole antifungal agents | F2G LTD (GB) | 2014-10-15 | — | — | EP | disclosed |
| EP-2626361-A1 | Pyrrole antifungal agents | F2G Limited (GB) | 2013-08-14 | — | — | EP | disclosed |
| 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 |