Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | S100A4 | P26447 | 2/20 | 0.41 |
| ▸ | PTPRC | P08575 | 1/20 | 0.41 |
| ▸ | MGAM | O43451 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | SI | P14410 | 2/20 | 0.40 |
| ▸ | MGAM2 | Q2M2H8 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | GUSB | P08236 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 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 | |
|---|---|---|---|---|
| SCHEMBL8374 | 0.83 | TDP1 (0.54) | TDP1ALDH1A1HSD17B10TSHRMEN1 | |
| SCHEMBL6195273 | 0.81 | ALDH1A1 (0.52) | TDP1ALDH1A1HSD17B10MAOBMEN1 | |
| SCHEMBL15640032 | 0.79 | ALDH1A1 (0.50) | TDP1ALDH1A1HSD17B10MAOBMEN1 | |
| SCHEMBL15639644 | 0.79 | ALDH1A1 (0.50) | TDP1ALDH1A1HSD17B10TSHRMEN1 | |
| SCHEMBL1287837 | 0.79 | ALDH1A1 (0.74) | TDP1ALDH1A1HSD17B10TSHRMEN1 | |
| SCHEMBL30535903 | 0.79 | ALDH1A1 (0.74) | TDP1ALDH1A1HSD17B10TSHRMEN1 | |
| SCHEMBL11473400 | 0.79 | ALDH1A1 (0.46) | TDP1ALDH1A1HSD17B10MAOBMEN1 | |
| SCHEMBL6079897 | 0.79 | ALDH1A1 (0.49) | TDP1ALDH1A1HSD17B10MEN1KMT2A | |
| SCHEMBL1206907 | 0.79 | ALDH1A1 (0.53) | TDP1ALDH1A1HSD17B10MAOBMEN1 | |
| SCHEMBL3357184 | 0.77 | HSD17B10 (0.55) | TDP1ALDH1A1HSD17B10TSHRMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1133475-A1 | SUBSTITUTED BENZO DE]ISOQUINOLINE-1,3-DIONES | MERCK PATENT GmbH (DE) | 2001-09-19 | — | — | EP | disclosed |
| WO-2000031039-A1 | SUBSTITUTED BENZO[DE]ISOQUINOLINE-1,3-DIONES | MERCK PATENT GMBH (DE) | 2000-06-02 | — | — | WO | disclosed |