Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | CA4 | P22748 | 1/20 | 0.47 |
| ▸ | LTA4H | P09960 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 2/20 | 0.42 |
| ▸ | ACACA | Q13085 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.40 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.40 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.39 |
| ▸ | ABL1 | P00519 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6047581 | 0.87 | ACHE (0.50) | ALDH1A1NPSR1NPC1RAB9AALOX5 | |
| SCHEMBL6047592 | 0.85 | ALOX5 (0.44) | ALDH1A1L3MBTL1NPC1RAB9AALOX5 | |
| SCHEMBL6047658 | 0.82 | NPC1 (0.41) | ALDH1A1KDM4ELMNATDP1L3MBTL1 | |
| SCHEMBL5886818 | 0.79 | CA12 (0.39) | ALDH1A1KDM4ELMNANPSR1TDP1 | |
| SCHEMBL5887069 | 0.78 | CA12 (0.38) | ALDH1A1KDM4ELMNANPSR1TDP1 | |
| SCHEMBL4808801 | 0.75 | APP (0.38) | ALDH1A1KDM4ELMNANPSR1TDP1 | |
| SCHEMBL6047631 | 0.75 | IDO1 (0.40) | ALDH1A1KDM4ELMNAL3MBTL1ACACA | |
| SCHEMBL17283658 | 0.73 | CA4 (0.68) | ALDH1A1KDM4ELMNANPSR1TDP1 | |
| SCHEMBL291776 | 0.73 | CA4 (0.68) | ALDH1A1KDM4ELMNANPSR1TDP1 | |
| SCHEMBL9152375 | 0.73 | CA4 (0.68) | ALDH1A1KDM4ELMNANPSR1TDP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2006501194-A | — | — | 2006-01-12 | — | — | JP | claimed |
| EP-1525190-A1 | CCK-1 RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2005-04-27 | — | — | EP | claimed |
| WO-2004007463-A1 | CCK-1 RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA, N.V. (BE) | 2004-01-22 | — | — | WO | claimed |