Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 2/20 | 0.45 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | IL2 | P60568 | 1/20 | 0.43 |
| ▸ | F10 | P00742 | 2/20 | 0.43 |
| ▸ | CSNK1D | P48730 | 4/20 | 0.42 |
| ▸ | CSNK1E | P49674 | 4/20 | 0.42 |
| ▸ | STIM1 | Q13586 | 1/20 | 0.42 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.42 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 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 | |
|---|---|---|---|---|
| SCHEMBL12155601 | 0.87 | NPC1 (0.60) | ABCB1SMN1; SMN2GAANPC1RAB9A | |
| SCHEMBL16572575 | 0.79 | ATR (0.43) | ABCB1ABCC1SMN1; SMN2GAANPC1 | |
| SCHEMBL12155623 | 0.78 | NPC1 (0.60) | SMN1; SMN2GAANPC1RAB9AKDM4E | |
| SCHEMBL12155612 | 0.78 | DEGS1 (0.54) | SMN1; SMN2GAANPC1RAB9AALDH1A1 | |
| SCHEMBL15853483 | 0.75 | RAB9A (0.58) | ABCB1ABCC1SMN1; SMN2GAANPC1 | |
| SCHEMBL2816063 | 0.73 | IL2 (0.49) | ABCB1ABCC1SMN1; SMN2GAANPC1 | |
| SCHEMBL12155841 | 0.73 | STIM1 (0.48) | ABCB1ABCC1SMN1; SMN2GAANPC1 | |
| SCHEMBL12155613 | 0.72 | IL2 (0.43) | ABCB1ABCC1SMN1; SMN2GAANPC1 | |
| SCHEMBL12155484 | 0.72 | STIM1 (0.55) | ABCB1ABCC1SMN1; SMN2GAANPC1 | |
| SCHEMBL12155548 | 0.72 | STIM1 (0.55) | ABCB1ABCC1SMN1; SMN2GAANPC1 |
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-2011139489-A2 | COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM | CALCIMEDICA INC. (US) | 2011-11-10 | — | — | WO | disclosed |