Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 9/20 | 0.43 |
| ▸ | RAB9A | P51151 | 9/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.39 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL12155626 | 0.88 | NPC1 (0.43) | NPC1RAB9ASMN1; SMN2PKMMAPT | |
| SCHEMBL12241926 | 0.77 | ALDH2 (0.46) | NPC1RAB9ASMN1; SMN2PKMMAPT | |
| SCHEMBL12241441 | 0.76 | RAB9A (0.43) | NPC1RAB9ASMN1; SMN2PKMMAPT | |
| SCHEMBL12155451 | 0.74 | ALDH2 (0.44) | NPC1RAB9ASMN1; SMN2PKMMAPT | |
| SCHEMBL12156254 | 0.74 | POLB (0.50) | NPC1RAB9ASMN1; SMN2PKMMAPT | |
| SCHEMBL12155503 | 0.73 | RAB9A (0.52) | NPC1RAB9ASMN1; SMN2KMT2AALDH1A1 | |
| SCHEMBL12155769 | 0.73 | SMN1; SMN2 (0.49) | NPC1RAB9ASMN1; SMN2KMT2AKDM4E | |
| SCHEMBL12241892 | 0.72 | STIM1 (0.53) | NPC1RAB9ASMN1; SMN2PKMKMT2A | |
| SCHEMBL12241661 | 0.71 | STIM1 (0.39) | NPC1RAB9ASMN1; SMN2PKMKMT2A | |
| SCHEMBL16885484 | 0.71 | NPC1 (0.57) | NPC1RAB9ASMN1; SMN2PKMMAPT |
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 |