Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLAU | P00749 | 1/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
| ▸ | MAPT | P10636 | 4/20 | 0.57 |
| ▸ | GAA | P10253 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 3/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 3/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.52 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.52 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.52 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL11628339 | 0.86 | NLRP3 (0.61) | CYP1A2MAPTGAAMEN1KMT2A | |
| SCHEMBL28549583 | 0.86 | CYP1A2 (0.72) | PLAUCYP1A2MAPTGAAMEN1 | |
| SCHEMBL13501314 | 0.85 | MAPT (0.71) | MAPTGAAKMT2AL3MBTL1RAB9A | |
| SCHEMBL4628541 | 0.83 | MAPT (0.63) | PLAUMAPTGAARAB9ALMNA | |
| SCHEMBL1074012 | 0.81 | MAPT (0.68) | PLAUMAPTGAAPOLBRAB9A | |
| SCHEMBL7839198 | 0.81 | RAB9A (0.64) | MAPTGAAPOLBRAB9ALMNA | |
| Hydrochloric Acid SCHEMBL8392031 | 0.81 | MAPT (0.77) | PLAUMAPTGAAPOLBRAB9A | |
| SCHEMBL7837786 | 0.79 | SENP1 (0.62) | MAPTGAARAB9AALDH1A1HDAC1 | |
| SCHEMBL7828031 | 0.79 | KMT2A (0.59) | MAPTGAAMEN1KMT2APOLB | |
| SCHEMBL306804 | 0.79 | RAB9A (0.65) | CYP1A2GAAKMT2APOLBRAB9A |
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-1144381-A2 | SUBSTITUTED BENZO[DE]ISOQUINOLINE-1,3-DIONES | MERCK PATENT GmbH (DE) | 2001-10-17 | — | — | EP | disclosed |
| WO-2000032577-A2 | SUBSTITUTED BENZO[DE]ISOQUINOLINE-1,3-DIONES | MERCK PATENT GMBH (DE) | 2000-06-08 | — | — | WO | disclosed |