Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.47 |
| ▸ | HPGD | P15428 | 4/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 9/20 | 0.44 |
| ▸ | NPC1 | O15118 | 8/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | PIM1 | P11309 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1900722 | 0.93 | KDM4E (0.47) | KDM4EHPGDHSD17B10ALDH1A1NPSR1 | |
| SCHEMBL1952447 | 0.90 | KDM4E (0.50) | KDM4EHPGDHSD17B10ALDH1A1NPSR1 | |
| SCHEMBL1953115 | 0.82 | NPC1 (0.50) | KDM4EHPGDHSD17B10ALDH1A1NPSR1 | |
| SCHEMBL1954886 | 0.80 | RAB9A (0.53) | KDM4EHPGDHSD17B10ALDH1A1NPSR1 | |
| SCHEMBL1952273 | 0.77 | TP53 (0.53) | KDM4EHPGDHSD17B10ALDH1A1NPSR1 | |
| SCHEMBL12756463 | 0.77 | KDM4E (0.52) | KDM4EHPGDHSD17B10ALDH1A1NPSR1 | |
| SCHEMBL1954147 | 0.76 | NPC1 (0.50) | KDM4EHPGDHSD17B10ALDH1A1NPSR1 | |
| SCHEMBL1953050 | 0.75 | NPC1 (0.54) | KDM4EHPGDHSD17B10ALDH1A1LMNA | |
| SCHEMBL1951949 | 0.73 | RAB9A (0.44) | KDM4EHPGDHSD17B10ALDH1A1NPSR1 | |
| SCHEMBL1952242 | 0.73 | NPC1 (0.47) | KDM4EHPGDHSD17B10ALDH1A1LMNA |
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-2321303-A2 | COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM | Calcimedica, Inc. (US) | 2011-05-18 | — | — | EP | disclosed |
| WO-2010027875-A2 | COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM | CALCIMEDICA INC. (US) | 2010-03-11 | — | — | WO | disclosed |