Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.77 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.67 |
| ▸ | MEN1 | O00255 | 3/20 | 0.67 |
| ▸ | ATM | Q13315 | 1/20 | 0.64 |
| ▸ | TSHR | P16473 | 6/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | TTR | P02766 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.52 |
| ▸ | MYLK | Q15746 | 2/20 | 0.52 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.52 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.52 |
| ▸ | PRKX | P51817 | 1/20 | 0.52 |
| ▸ | PRKCE | Q02156 | 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 | |
|---|---|---|---|---|
| SCHEMBL13788913 | 0.84 | KMT2A (0.63) | SMN1; SMN2KMT2AMEN1ATMALDH1A1 | |
| SCHEMBL11200997 | 0.83 | TSHR (0.65) | SMN1; SMN2KMT2AMEN1ATMTSHR | |
| SCHEMBL8140330 | 0.83 | TSHR (0.75) | SMN1; SMN2KMT2AMEN1TSHRCYP3A4 | |
| SCHEMBL1439966 | 0.83 | TSHR (0.75) | SMN1; SMN2KMT2AMEN1TSHRCYP3A4 | |
| SCHEMBL10719519 | 0.82 | SMN1; SMN2 (0.80) | SMN1; SMN2KMT2AMEN1ATMTSHR | |
| SCHEMBL25532 | 0.81 | POLB (0.58) | SMN1; SMN2KMT2AMEN1ATMTSHR | |
| SCHEMBL10876385 | 0.81 | SMN1; SMN2 (0.62) | SMN1; SMN2KMT2AMEN1ATMTSHR | |
| SCHEMBL5342056 | 0.81 | TSHR (0.71) | SMN1; SMN2KMT2AMEN1ATMTSHR | |
| SCHEMBL12086998 | 0.81 | TSHR (0.61) | SMN1; SMN2KMT2AMEN1ATMTSHR | |
| SCHEMBL29452018 | 0.81 | TSHR (0.61) | SMN1; SMN2KMT2AMEN1ATMTSHR |
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 |