Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | STIM1 | Q13586 | 8/20 | 0.47 |
| ▸ | ORAI1 | Q96D31 | 8/20 | 0.47 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | ESRRG | P62508 | 1/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10254718 | 0.90 | STIM1 (0.59) | MAPTRAB9ASTIM1ORAI1ESR1 | |
| SCHEMBL10254447 | 0.85 | RAB9A (0.49) | MAPTRAB9ANPC1STIM1ORAI1 | |
| SCHEMBL10254738 | 0.83 | STIM1 (0.59) | RAB9ANPC1STIM1ORAI1ESRRG | |
| SCHEMBL10254706 | 0.83 | STIM1 (0.51) | RAB9ANPC1STIM1ORAI1HDAC3 | |
| SCHEMBL10254445 | 0.81 | STIM1 (0.49) | RAB9ANPC1STIM1ORAI1HDAC3 | |
| SCHEMBL10254750 | 0.80 | STIM1 (0.65) | RAB9ANPC1STIM1ORAI1HDAC3 | |
| SCHEMBL10201182 | 0.78 | STIM1 (0.66) | MAPTRAB9ANPC1STIM1ORAI1 | |
| SCHEMBL10201161 | 0.76 | STIM1 (0.54) | MAPTRAB9ANPC1STIM1ORAI1 | |
| SCHEMBL10201144 | 0.76 | MAPT (0.53) | MAPTRAB9ANPC1STIM1ORAI1 | |
| SCHEMBL10201167 | 0.76 | STIM1 (0.68) | MAPTRAB9ANPC1STIM1ORAI1 |
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 |