Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.55 |
| ▸ | RAB9A | P51151 | 4/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.55 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | DPP4 | P27487 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL439457 | 0.87 | NPC1 (0.57) | NPC1RAB9AKMT2AHSP90AA1MAPK1 | |
| SCHEMBL730189 | 0.86 | MAPK1 (0.46) | NPC1RAB9AKMT2AMAPK1THRB | |
| SCHEMBL441793 | 0.85 | TP53 (0.56) | NPC1RAB9AKMT2AHSP90AA1THRB | |
| SCHEMBL436591 | 0.82 | GABRP (0.47) | KMT2AKDM4EMEN1 | |
| SCHEMBL438293 | 0.82 | NPC1 (0.55) | NPC1RAB9AKMT2AHSP90AA1MAPK1 | |
| SCHEMBL438821 | 0.80 | KMT2A (0.55) | NPC1RAB9AKMT2AHSP90AA1MAPK1 | |
| SCHEMBL439271 | 0.80 | MAPK1 (0.65) | NPC1RAB9AKMT2AMAPK1THRB | |
| SCHEMBL438878 | 0.79 | KMT2A (0.71) | NPC1RAB9AKMT2AMAPK1ALDH1A1 | |
| SCHEMBL16229844 | 0.77 | NPC1 (0.50) | NPC1RAB9AKMT2AHSP90AA1ALDH1A1 | |
| SCHEMBL436629 | 0.77 | KMT2A (0.65) | NPC1RAB9AKMT2AHSP90AA1THRB |
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 |
|---|---|---|---|---|---|---|---|
| US-20120065166-A1 | Bone Modulators And Methods Therewith | ESPINA VIRGINIA (US) | 2012-03-15 | — | — | US | disclosed |