Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.43 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | KIF11 | P52732 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.41 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | PTGFR | P43088 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14879458 | 0.82 | MEN1 (0.46) | TRPV1NPC1RAB9ALMNAKDM4E | |
| SCHEMBL14879483 | 0.80 | PTPRC (0.48) | NPC1RAB9ALMNAKDM4EHPGD | |
| SCHEMBL14879519 | 0.72 | IKBKB (0.42) | KIF11ALDH1A1SMN1; SMN2 | |
| SCHEMBL16009318 | 0.72 | F10 (0.47) | TRPV1LMNAKDM4EGAAMAPT | |
| SCHEMBL14879607 | 0.70 | NPC1 (0.45) | NPC1RAB9ALMNAKDM4ENTRK1 | |
| SCHEMBL14879598 | 0.70 | TRPA1 (0.47) | RAB9ALMNA | |
| SCHEMBL30599567 | 0.69 | MAPT (0.71) | NPC1RAB9ALMNAKDM4EHPGD | |
| SCHEMBL9052069 | 0.69 | KDM4E (0.41) | NPC1RAB9AKDM4EHPGDGAA | |
| SCHEMBL31425031 | 0.69 | TRPV1 (0.56) | TRPV1KDM4EHPGDGAAMAPT | |
| SCHEMBL5739678 | 0.68 | NPC1 (0.55) | NPC1RAB9ALMNAKDM4EGAA |
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-2768810-A1 | COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM | Calcimedica, Inc. (US) | 2014-08-27 | — | — | EP | disclosed |
| WO-2013059666-A1 | COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM | CALCIMEDICA, INC. (US) | 2013-04-25 | — | — | WO | disclosed |