Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STIM1 | Q13586 | 4/20 | 0.51 |
| ▸ | ORAI1 | Q96D31 | 4/20 | 0.51 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.46 |
| ▸ | DEGS1 | O15121 | 2/20 | 0.42 |
| ▸ | F10 | P00742 | 5/20 | 0.40 |
| ▸ | NPC1 | O15118 | 4/20 | 0.40 |
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12156032 | 0.88 | STIM1 (0.51) | STIM1ORAI1ORAI2DEGS1NPC1 | |
| SCHEMBL12156035 | 0.86 | STIM1 (0.49) | STIM1ORAI1ORAI2DEGS1NPC1 | |
| SCHEMBL12241547 | 0.85 | RAB9A (0.55) | STIM1ORAI1ORAI2DEGS1F10 | |
| SCHEMBL12155519 | 0.85 | STIM1 (0.57) | STIM1ORAI1ORAI2DEGS1F10 | |
| SCHEMBL17049821 | 0.84 | DEGS1 (0.53) | STIM1ORAI1ORAI2DEGS1F10 | |
| SCHEMBL12241448 | 0.84 | STIM1 (0.48) | STIM1ORAI1ORAI2DEGS1NPC1 | |
| SCHEMBL17049614 | 0.83 | STIM1 (0.50) | STIM1ORAI1ORAI2DEGS1F10 | |
| SCHEMBL12156036 | 0.82 | STIM1 (0.64) | STIM1ORAI1ORAI2NPC1RAB9A | |
| SCHEMBL12155457 | 0.81 | STIM1 (0.60) | STIM1ORAI1ORAI2DEGS1NPC1 | |
| SCHEMBL22509378 | 0.81 | STIM1 (0.50) | STIM1ORAI1ORAI2DEGS1F10 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2563776-B1 | COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM | CALCIMEDICA INC (US) | 2016-06-08 | — | — | EP | disclosed |