Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.39 |
| ▸ | ABAT | P80404 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.38 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.38 |
| ▸ | TYR | P14679 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | DRD1 | P21728 | 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 | |
|---|---|---|---|---|
| SCHEMBL3976211 | 0.78 | CYP2A6 (0.52) | KMT2ACYP2A6HSD17B10ALDH5A1ABAT | |
| SCHEMBL9607165 | 0.77 | KMT2A (0.61) | KMT2ACYP2A6HSD17B10ALDH5A1ABAT | |
| SCHEMBL17508314 | 0.75 | KMT2A (0.42) | KMT2ACYP2A6HSD17B10ALDH5A1ABAT | |
| SCHEMBL19058004 | 0.73 | IDO1 (0.42) | KMT2ACYP2A6ALDH1A1LMNAMAPT | |
| SCHEMBL22482697 | 0.72 | HDAC8 (0.38) | LMNAMAPTMAOAMAOB | |
| SCHEMBL18160981 | 0.72 | CYP2A6 (0.46) | KMT2ACYP2A6HSD17B10ALDH5A1ABAT | |
| SCHEMBL505983 | 0.72 | HSD17B10 (0.52) | KMT2ACYP2A6HSD17B10ALDH5A1ABAT | |
| SCHEMBL15104760 | 0.72 | CALM1 (0.55) | ALDH1A1MAPTKDM4E | |
| SCHEMBL2929000 | 0.72 | CYP2A6 (0.46) | KMT2ACYP2A6HSD17B10ALDH5A1ABAT | |
| SCHEMBL18568291 | 0.71 | SRD5A2 (0.40) | KMT2AALDH1A1LMNASMN1; SMN2EPHX2 |
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 |