Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 10/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 10/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1026632 | 0.83 | CHRNB2 (0.48) | LMNASMN1; SMN2POLBMAPTMAOB | |
| SCHEMBL1026635 | 0.83 | CHRNB2 (0.48) | LMNASMN1; SMN2POLBMAPTMAOB | |
| SCHEMBL1025198 | 0.83 | MCL1 (0.41) | POLBMAOBL3MBTL1 | |
| SCHEMBL1025196 | 0.80 | FFAR1 (0.36) | CYP3A4SMN1; SMN2MAOB | |
| SCHEMBL1028344 | 0.80 | F2 (0.40) | TSHRTP53CYP3A4NPC1RAB9A | |
| SCHEMBL1028822 | 0.77 | CTSC (0.39) | — | |
| SCHEMBL1026693 | 0.77 | ALDH1A1 (0.42) | CYP3A4LMNANPC1SMN1; SMN2POLB | |
| SCHEMBL1025746 | 0.76 | SMN1; SMN2 (0.47) | TSHRRAB9ASMN1; SMN2POLBTDP1 | |
| SCHEMBL13623108 | 0.75 | SMN1; SMN2 (0.43) | TSHRLMNANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL1026191 | 0.71 | MAOA (0.50) | MAOBL3MBTL1GAA |
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-2274288-A2 | MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS | Incyte Corporation (US) | 2011-01-19 | — | — | EP | disclosed |