Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MITF | O75030 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.31 |
| ▸ | AR | P10275 | 2/20 | 0.31 |
| ▸ | DUT | P33316 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14965734 | 0.90 | NR1D1 (0.38) | MITFLMNAALDH1A1 | |
| SCHEMBL14969412 | 0.90 | NR1D1 (0.36) | MITFPOLBALDH1A1SOS1 | |
| SCHEMBL14969684 | 0.89 | NR1D1 (0.36) | MITFLMNAALDH1A1SOS1 | |
| SCHEMBL14965850 | 0.88 | MITF (0.35) | MITFLMNAPOLB | |
| SCHEMBL14965539 | 0.88 | NR1H3 (0.39) | MITFALDH1A1 | |
| SCHEMBL14965763 | 0.88 | MITF (0.34) | MITFLMNASOS1 | |
| SCHEMBL14966100 | 0.88 | KCNH2 (0.40) | MITFALDH1A1SOS1 | |
| SCHEMBL14965670 | 0.87 | MITF (0.35) | MITFLMNACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL14966156 | 0.87 | KCNH2 (0.37) | CYP2D6 | |
| SCHEMBL14965947 | 0.86 | MEP1B (0.37) | MITFLMNACYP2D6 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013072903-A1 | NITROIMIDAZOXADIAZOCINE COMPOUNDS | ITHEMBA PHARMACEUTICALS (PROPRIETARY) LIMITED (ZA) | 2013-05-23 | — | — | WO | disclosed |