Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.45 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.45 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.45 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL1367739 | 0.81 | ADRB1 (0.42) | NPSR1TSHRSMN1; SMN2ADRB1ALDH1A1 | |
| SCHEMBL17884461 | 0.81 | ADRB1 (0.69) | TSHRADRB1HTR6 | |
| Ammonia Solution, Strong SCHEMBL28470704 | 0.80 | HPGD (0.58) | MEN1LMNAKMT2ATSHRSMN1; SMN2 | |
| SCHEMBL8894088 | 0.80 | LMNA (0.68) | GAAMEN1LMNAKMT2ANPSR1 | |
| SCHEMBL9065218 | 0.80 | LMNA (0.68) | GAAMEN1LMNAKMT2ANPSR1 | |
| SCHEMBL30228454 | 0.80 | LMNA (0.68) | GAAMEN1LMNAKMT2ANPSR1 | |
| SCHEMBL5716359 | 0.80 | NPSR1 (0.49) | GAAMEN1KMT2ANPSR1KEAP1 | |
| SCHEMBL6005480 | 0.79 | KEAP1 (0.57) | GAAMEN1LMNAKMT2ANPSR1 | |
| SCHEMBL30851436 | 0.79 | KEAP1 (0.57) | GAAMEN1LMNAKMT2ANPSR1 | |
| SCHEMBL1239113 | 0.79 | KEAP1 (0.57) | GAAMEN1LMNAKMT2ANPSR1 |
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-2640367-A2 | BENZOXAZEPINES AS INHIBITORS OF PI3K/MTOR AND METHODS OF THEIR USE AND MANUFACTURE | Exelixis, Inc. (US) | 2013-09-25 | — | — | EP | disclosed |
| WO-2012068106-A2 | BENZOXAZEPINES AS INHIBITORS OF PI3K/MTOR AND METHODS OF THEIR USE AND MANUFACTURE | EXELIXIS, INC. (US) | 2012-05-24 | — | — | WO | disclosed |