Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | NPY1R | P25929 | 1/20 | 0.48 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.48 |
| ▸ | MGLL | Q99685 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.42 |
| ▸ | SYK | P43405 | 2/20 | 0.41 |
| ▸ | CFD | P00746 | 2/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL22631193 | 0.83 | MAPT (0.54) | MAPTALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7838920 | 0.82 | PRKCA (0.40) | MAPTALDH1A1NPY1RNPY5RHTT | |
| SCHEMBL1072934 | 0.81 | MAPT (0.73) | MAPTALDH1A1HDAC1HDAC3HDAC2 | |
| SCHEMBL14149699 | 0.81 | MAPT (0.50) | MAPTALDH1A1MGLLCYP1A2CYP3A4 | |
| SCHEMBL30505169 | 0.81 | MAPT (0.50) | MAPTALDH1A1MGLLCYP1A2CYP3A4 | |
| SCHEMBL28653602 | 0.81 | ALDH1A1 (0.50) | MAPTALDH1A1MGLLHDAC6HDAC1 | |
| Hydrochloric Acid SCHEMBL12477885 | 0.79 | ALDH1A1 (0.70) | MAPTALDH1A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL11935615 | 0.79 | ALDH1A1 (0.52) | MAPTALDH1A1NPY1RNPY5RTAAR1 | |
| SCHEMBL11934955 | 0.79 | ALDH1A1 (0.52) | MAPTALDH1A1NPY1RNPY5RTAAR1 | |
| SCHEMBL11253095 | 0.77 | MAPT (0.46) | MAPTALDH1A1MGLLCYP1A2CYP3A4 |
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 |