Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.48 |
| ▸ | GAA | P10253 | 3/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | PGR | P06401 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | HPGD | P15428 | 4/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | RORA | P35398 | 2/20 | 0.44 |
| ▸ | RORC | P51449 | 2/20 | 0.44 |
| ▸ | RORB | Q92753 | 2/20 | 0.44 |
| ▸ | CNR2 | P34972 | 2/20 | 0.43 |
| ▸ | BLM | P54132 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | GMNN | O75496 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL18687684 | 0.78 | KMT2A (0.51) | KDM4EGAAALDH1A1HPGDHSD17B10 | |
| SCHEMBL7316040 | 0.75 | KDM4E (0.41) | KDM4EGAAL3MBTL1ALDH1A1HPGD | |
| SCHEMBL18669082 | 0.73 | ALDH1A1 (0.48) | KDM4EGAATDP1L3MBTL1ALDH1A1 | |
| SCHEMBL9543780 | 0.72 | ALDH1A1 (0.41) | KDM4EGAATDP1L3MBTL1NPC1 | |
| SCHEMBL12506518 | 0.71 | KDM4E (0.54) | KDM4EGAATDP1ALDH1A1HPGD | |
| SCHEMBL11471575 | 0.70 | CYP1A2 (0.46) | KDM4EGAATDP1L3MBTL1NPC1 | |
| SCHEMBL5624283 | 0.70 | TDP1 (0.54) | KDM4ETDP1L3MBTL1NPC1PGR | |
| SCHEMBL18500599 | 0.69 | KMT2A (0.50) | KDM4EGAATDP1L3MBTL1PGR | |
| SCHEMBL12971677 | 0.68 | ALDH1A1 (0.59) | KDM4EGAATDP1L3MBTL1NPC1 | |
| SCHEMBL29809435 | 0.68 | TNF (0.59) | KDM4ETDP1POLBCNR2KMT2A |
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-1284967-A1 | 3-SUBSTITUTED ISOQUINOLIN-1-YL DERIVATIVES | Celltech R&D Limited (GB) | 2003-02-26 | — | — | EP | disclosed |
| WO-2001092233-A1 | 3-SUBSTITUTED ISOQUINOLIN-1-YL DERIVATIVES | CELLTECH R & D LIMITED (GB) | 2001-12-06 | — | — | WO | disclosed |