Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 1/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | DAO | P14920 | 1/20 | 0.40 |
| ▸ | KIF11 | P52732 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.37 |
| ▸ | ABAT | P80404 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL18001938 | 0.85 | MAOA (0.45) | CYP17A1CYP11B1CYP11B2DAOALDH1A1 | |
| SCHEMBL17508314 | 0.84 | KMT2A (0.42) | KMT2AHSD17B10KIF11ALDH1A1CYP2A6 | |
| SCHEMBL18002256 | 0.83 | CYP17A1 (0.38) | CYP17A1CYP11B1CYP11B2HSD17B10DAO | |
| SCHEMBL3299911 | 0.82 | CYP17A1 (0.52) | CYP17A1CYP11B1CYP11B2DAOALDH1A1 | |
| SCHEMBL17508145 | 0.80 | KIF11 (0.53) | KMT2AKIF11 | |
| SCHEMBL3976211 | 0.80 | CYP2A6 (0.52) | KMT2AHSD17B10ALDH1A1CYP2A6ALDH5A1 | |
| SCHEMBL15774625 | 0.79 | RAB9A (0.63) | KMT2AALDH1A1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL9607165 | 0.79 | KMT2A (0.61) | KMT2AHSD17B10DAOALDH1A1NFE2L2 | |
| SCHEMBL29389102 | 0.78 | ALDH1A1 (0.52) | HSD17B10KIF11ALDH1A1NFE2L2CYP2A6 | |
| SCHEMBL48607 | 0.78 | ALDH1A1 (0.52) | HSD17B10KIF11ALDH1A1NFE2L2CYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016019588-A1 | OXACAZONE COMPOUNDS TO TREAT CLOSTRIDIUM DIFFICILE | THE BROAD INSTITUTE, INC. (US) | 2016-02-11 | — | — | WO | disclosed |
| WO-2016019588-A1 | OXACAZONE COMPOUNDS TO TREAT CLOSTRIDIUM DIFFICILE | THE BROAD INSTITUTE, INC. (US) | 2016-02-11 | — | — | WO | disclosed |