Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.50 |
| ▸ | MEN1 | O00255 | 5/20 | 0.50 |
| ▸ | MAPT | P10636 | 5/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.45 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | BRAF | P15056 | 1/20 | 0.44 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4398112 | 0.79 | TSHR (0.45) | GAARAB9ASMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL4398448 | 0.77 | L3MBTL1 (0.40) | GAARAB9ASMN1; SMN2KDM4EL3MBTL1 | |
| SCHEMBL19793350 | 0.76 | GAA (0.47) | GAAKMT2AMEN1MAPTRAB9A | |
| SCHEMBL31609727 | 0.75 | MAPK1 (0.46) | KMT2AMEN1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL22339324 | 0.75 | MEN1 (0.56) | GAAKMT2AMEN1MAPTRAB9A | |
| SCHEMBL30739610 | 0.74 | GAA (0.62) | GAAKMT2AMEN1RAB9ANPC1 | |
| SCHEMBL20051587 | 0.74 | GAA (0.62) | GAAKMT2AMEN1RAB9ANPC1 | |
| SCHEMBL5504642 | 0.74 | MEN1 (0.83) | GAAKMT2AMEN1MAPTRAB9A | |
| SCHEMBL30739749 | 0.72 | JAK2 (0.71) | GAAKMT2AMEN1RAB9ASMN1; SMN2 | |
| SCHEMBL10683473 | 0.71 | RXFP1 (0.51) | GAAKMT2AMEN1MAPTRAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1807078-A1 | DIAMINOALKANE ASPARTIC PROTEASE INHIBITORS | Vitae Pharmaceuticals, Inc. (US) | 2007-07-18 | — | — | EP | disclosed |
| WO-2006042150-A1 | DIAMINOALKANE ASPARTIC PROTEASE INHIBITORS | VITAE PHARMACEUTICALS, INC. (US) | 2006-04-20 | — | — | WO | disclosed |