Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.62 |
| ▸ | MAPT | P10636 | 1/20 | 0.62 |
| ▸ | NPC1 | O15118 | 5/20 | 0.61 |
| ▸ | RAB9A | P51151 | 5/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.61 |
| ▸ | LMNA | P02545 | 1/20 | 0.61 |
| ▸ | CASP3 | P42574 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | HPGD | P15428 | 2/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.58 |
| ▸ | GLA | P06280 | 1/20 | 0.58 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.58 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.58 |
| ▸ | RELA | Q04206 | 1/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.58 |
| ▸ | GPR119 | Q8TDV5 | 4/20 | 0.56 |
| ▸ | ESR1 | P03372 | 6/20 | 0.56 |
| ▸ | ESR2 | Q92731 | 6/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL4052772 | 0.92 | NPC1 (0.69) | HSD17B10MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4059683 | 0.88 | NPC1 (0.65) | HSD17B10MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL13254481 | 0.87 | ESR1 (0.58) | HSD17B10MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4056991 | 0.87 | NPC1 (0.62) | HSD17B10MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4052671 | 0.87 | NPC1 (0.62) | HSD17B10MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4053396 | 0.86 | RAB9A (0.70) | HSD17B10MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4052771 | 0.85 | NPC1 (0.61) | HSD17B10MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4053485 | 0.85 | NPC1 (0.66) | HSD17B10MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL13620320 | 0.85 | NPC1 (0.64) | HSD17B10MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4055495 | 0.83 | NPC1 (0.58) | HSD17B10MAPTNPC1RAB9ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7622479-B2 | Bicyclic derivative, its production and use | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-11-24 | — | — | US | disclosed |