Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STIM1 | Q13586 | 7/20 | 0.59 |
| ▸ | ORAI1 | Q96D31 | 7/20 | 0.59 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.42 |
| ▸ | IL2 | P60568 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | ESRRG | P62508 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10254718 | 0.90 | STIM1 (0.59) | STIM1ORAI1HDAC3HDAC4HDAC1 | |
| SCHEMBL10254750 | 0.88 | STIM1 (0.65) | STIM1ORAI1HDAC3HDAC4HDAC1 | |
| SCHEMBL10254706 | 0.85 | STIM1 (0.51) | STIM1ORAI1HDAC3HDAC4HDAC1 | |
| SCHEMBL10254445 | 0.84 | STIM1 (0.49) | STIM1ORAI1HDAC3HDAC4HDAC1 | |
| SCHEMBL10254713 | 0.83 | MAPT (0.48) | STIM1ORAI1HDAC3HDAC4HDAC1 | |
| SCHEMBL10201129 | 0.77 | STIM1 (0.85) | STIM1ORAI1HDAC3HDAC4HDAC1 | |
| SCHEMBL721220 | 0.77 | STIM1 (0.69) | STIM1ORAI1HDAC3HDAC4HDAC1 | |
| SCHEMBL29642107 | 0.77 | STIM1 (0.69) | STIM1ORAI1HDAC3HDAC4HDAC1 | |
| SCHEMBL10255269 | 0.77 | STIM1 (0.65) | STIM1ORAI1RAB9AALDH1A1NPC1 | |
| SCHEMBL10201116 | 0.76 | STIM1 (0.67) | STIM1ORAI1HDAC3HDAC4HDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012027710-A2 | COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM | CALCIMEDICA INC. (US) | 2012-03-01 | — | — | WO | disclosed |