Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HTR2A | P28223 | 3/20 | 0.34 |
| ▸ | HTR2C | P28335 | 3/20 | 0.34 |
| ▸ | HTR2B | P41595 | 3/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.33 |
| ▸ | PPIB | P23284 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | BACE1 | P56817 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29620731 | 0.79 | TDP1 (0.56) | L3MBTL1TDP1MAPK1CES1 | |
| SCHEMBL6794055 | 0.79 | ESR1 (0.44) | LMNAALDH1A1MAOA | |
| SCHEMBL1463836 | 0.79 | TDP1 (0.56) | L3MBTL1TDP1MAPK1CES1 | |
| SCHEMBL6799540 | 0.76 | PPIB (0.58) | L3MBTL1NPSR1LMNAALDH1A1HTR2A | |
| SCHEMBL17355125 | 0.74 | BACE1 (0.39) | BACE1 | |
| SCHEMBL14026041 | 0.71 | MAOA (0.67) | L3MBTL1LMNAALDH1A1TDP1SMN1; SMN2 | |
| SCHEMBL6794708 | 0.70 | PBRM1 (0.46) | MAOA | |
| SCHEMBL1463869 | 0.70 | TDP1 (0.53) | L3MBTL1NPSR1HTR2AHTR2CHTR2B | |
| SCHEMBL31599138 | 0.70 | SIGMAR1 (0.51) | L3MBTL1NPSR1HTTLMNAPOLB | |
| SCHEMBL11500029 | 0.70 | SIGMAR1 (0.51) | L3MBTL1NPSR1HTTLMNAPOLB |
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-2406240-B1 | INHIBITORS OF BETA-SECRETASE | VITAE PHARMACEUTICALS INC (US) | 2015-12-23 | — | — | EP | disclosed |