Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL15162305 | 0.87 | KDM4E (0.46) | ALDH1A1KDM4ESMN1; SMN2TSHRHTT | |
| SCHEMBL2049182 | 0.81 | ALDH1A1 (0.65) | ALDH1A1KDM4ESMN1; SMN2TSHRHTT | |
| SCHEMBL1126995 | 0.79 | GFER (0.39) | ALDH1A1KDM4ESMN1; SMN2MEN1KMT2A | |
| SCHEMBL1127046 | 0.77 | CNR1 (0.46) | ALDH1A1KDM4EKMT2AGAAL3MBTL1 | |
| SCHEMBL1126911 | 0.74 | HTR2C (0.41) | ALDH1A1KDM4ESMN1; SMN2CYP1A2POLB | |
| SCHEMBL1127116 | 0.72 | LMNA (0.42) | ALDH1A1KDM4ESMN1; SMN2TSHRHTT | |
| SCHEMBL23488097 | 0.69 | THRB (0.40) | ALDH1A1KDM4ESMN1; SMN2TSHRHTT | |
| SCHEMBL22234295 | 0.69 | ESR1 (0.57) | ALDH1A1KDM4ESMN1; SMN2TSHRHTT | |
| SCHEMBL31325508 | 0.69 | ALDH1A1 (0.56) | ALDH1A1KDM4ESMN1; SMN2TSHRHTT | |
| SCHEMBL1126957 | 0.69 | ALDH1A1 (0.50) | ALDH1A1KDM4ESMN1; SMN2TSHRHTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2283006-B1 | PYRROLE ANTIFUNGAL AGENTS | F2G LTD (GB) | 2015-02-25 | — | — | EP | disclosed |
| 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 |