Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | GPR183 | P32249 | 6/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | 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 | |
|---|---|---|---|---|
| SCHEMBL27567573 | 0.85 | FKBP1A (0.45) | GPR183SIGMAR1ALDH1A1MAPTHTT | |
| SCHEMBL27503682 | 0.75 | PKM (0.55) | NPC1RAB9AL3MBTL1ALDH1A1MAPT | |
| SCHEMBL2929978 | 0.74 | L3MBTL1 (0.71) | NPC1L3MBTL1ALDH1A1 | |
| SCHEMBL27562279 | 0.74 | KMT2A (0.43) | GPR183ALDH1A1MAPTLMNA | |
| SCHEMBL2377883 | 0.72 | L3MBTL1 (0.51) | NPC1L3MBTL1GPR183SIGMAR1ALDH1A1 | |
| SCHEMBL27613828 | 0.69 | MAPT (0.51) | NPC1RAB9AL3MBTL1GPR183SIGMAR1 | |
| SCHEMBL27736332 | 0.69 | TSHR (0.42) | NPC1RAB9AL3MBTL1ALDH1A1MAPT | |
| SCHEMBL1156725 | 0.68 | ATM (0.69) | L3MBTL1ALDH1A1HTTLMNA | |
| SCHEMBL28744149 | 0.68 | ALDH1A1 (0.40) | L3MBTL1GPR183ALDH1A1MAPT | |
| SCHEMBL27794123 | 0.67 | GPR183 (0.40) | L3MBTL1GPR183SIGMAR1ALDH1A1MAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102775396-B | Modulators of ATP-binding cassette transporters | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2014-10-08 | — | — | CN | disclosed |
| CN-102775396-A | Modulators of ATP-binding cassette transporters | VERTEX PHARMA | 2012-11-14 | — | — | CN | disclosed |
| CN-101356170-B | Heterocyclic modulators of ATP-binding cassette transporters | VERTEX PHARMA | 2012-09-26 | — | — | CN | disclosed |
| CN-101356170-A | Heterocyclic modulators of ATP-binding cassette transporters | VERTEX PHARMA (US) | 2009-01-28 | — | — | CN | disclosed |