Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
| ▸ | NUDT1 | P36639 | 2/20 | 0.35 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
| ▸ | RORC | P51449 | 1/20 | 0.34 |
| ▸ | RORB | Q92753 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1126583 | 0.84 | JAK2 (0.48) | EGFRTP53MAPK1HPGDCYP1A2 | |
| SCHEMBL1127138 | 0.69 | PYGL (0.34) | TP53CYP1A2 | |
| SCHEMBL1126989 | 0.69 | ALDH1A1 (0.39) | EGFRTP53HPGDCYP1A2SLC6A9 | |
| SCHEMBL1127129 | 0.69 | NUDT1 (0.42) | EGFRTP53HPGDNUDT1SLC6A9 | |
| SCHEMBL1126847 | 0.68 | MCL1 (0.37) | MAPK1HPGD | |
| SCHEMBL1989510 | 0.68 | CNR1 (0.41) | TP53MAPK1SLC6A3HPGDCYP1A2 | |
| SCHEMBL1127376 | 0.67 | LMNA (0.40) | TP53HPGDCYP1A2CYP2C19 | |
| SCHEMBL1127247 | 0.62 | HTT (0.48) | MAPK1HPGDSTK3 | |
| SCHEMBL1127700 | 0.62 | KDM4E (0.40) | HPGD | |
| SCHEMBL10508590 | 0.62 | SLC6A3 (0.54) | EGFRSLC6A3HPGDSLC6A2RORC |
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 |