Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.76 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
| ▸ | GLI1 | P08151 | 1/20 | 0.41 |
| ▸ | GLI2 | P10070 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.39 |
| ▸ | DPP3 | Q9NY33 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 2/20 | 0.38 |
| ▸ | DAO | P14920 | 1/20 | 0.38 |
| ▸ | DDO | Q99489 | 1/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3392890 | 0.91 | NQO1 (0.90) | NQO1GLI1GLI2MAOAMEN1 | |
| SCHEMBL12425672 | 0.80 | ABCG2 (0.49) | NQO1ABCB1MAOACYP1A2TNKS2 | |
| SCHEMBL12393724 | 0.75 | NQO1 (0.65) | NQO1GLI1GLI2MAOAMEN1 | |
| SCHEMBL7741845 | 0.72 | CDK5 (0.48) | NQO1MAOAMEN1KMT2AALDH1A1 | |
| SCHEMBL3392816 | 0.71 | NQO1 (0.59) | NQO1ABCB1MEN1MAPTKMT2A | |
| SCHEMBL12393704 | 0.71 | NQO1 (0.55) | NQO1MAOACYP1A2MEN1MAPT | |
| SCHEMBL16852337 | 0.70 | NQO1 (0.47) | NQO1ABCB1MAOADPP3MAPT | |
| SCHEMBL3388965 | 0.68 | NQO1 (0.55) | NQO1MAOADPP3MEN1MAPT | |
| SCHEMBL12393719 | 0.68 | NQO1 (0.51) | NQO1MEN1KMT2AALDH1A1KDM4E | |
| SCHEMBL14022430 | 0.67 | NQO1 (0.54) | NQO1ABCB1MAOAMEN1KMT2A |
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-2011101810-A1 | USE OF INDANTHRENE COMPOUNDS IN ORGANIC PHOTOVOLTAICS | BASF SE (DE) | 2011-08-25 | — | — | WO | disclosed |