Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | AOC3 | Q16853 | 4/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | NAPEPLD | Q6IQ20 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1025252 | 0.80 | ALDH1A1 (0.39) | MEN1KMT2ASMN1; SMN2NPC1ALDH1A1 | |
| SCHEMBL1023637 | 0.76 | KMT2A (0.46) | MEN1KMT2ASMN1; SMN2NPC1ALDH1A1 | |
| SCHEMBL1075283 | 0.76 | PDE2A (0.39) | SMN1; SMN2NPC1GAAKDM4EHPGD | |
| SCHEMBL1027667 | 0.76 | ALDH1A1 (0.44) | MEN1KMT2ASMN1; SMN2NPC1ALDH1A1 | |
| SCHEMBL13670051 | 0.75 | MAPT (0.48) | MEN1KMT2ASMN1; SMN2ALDH1A1GAA | |
| SCHEMBL17536983 | 0.72 | SMN1; SMN2 (0.50) | MEN1KMT2ASMN1; SMN2NPC1ALDH1A1 | |
| SCHEMBL13623214 | 0.71 | AKT1 (0.49) | MEN1KMT2ASMN1; SMN2NPC1ALDH1A1 | |
| SCHEMBL425066 | 0.70 | AKR1C3 (0.50) | MEN1KMT2ASMN1; SMN2NPC1ALDH1A1 | |
| SCHEMBL13622523 | 0.70 | AKT1 (0.41) | MEN1KMT2ASMN1; SMN2NPC1ALDH1A1 | |
| SCHEMBL428323 | 0.69 | ALDH1A1 (0.42) | MEN1KMT2ASMN1; SMN2NPC1ALDH1A1 |
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-2274288-A2 | MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS | Incyte Corporation (US) | 2011-01-19 | — | — | EP | disclosed |
| WO-2009132202-A2 | MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS | INCYTE CORPORATION (US) | 2009-10-29 | — | — | WO | disclosed |