Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 7/20 | 0.58 |
| ▸ | NPC1 | O15118 | 5/20 | 0.58 |
| ▸ | CASP3 | P42574 | 2/20 | 0.58 |
| ▸ | SENP8 | Q96LD8 | 2/20 | 0.58 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.58 |
| ▸ | SENP6 | Q9GZR1 | 2/20 | 0.58 |
| ▸ | ATM | Q13315 | 2/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 8/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.54 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.54 |
| ▸ | RELA | Q04206 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9647875 | 0.85 | SMN1; SMN2 (0.74) | RAB9ANPC1CASP3SENP8SENP7 | |
| SCHEMBL4728543 | 0.84 | RAB9A (0.44) | RAB9ANPC1CASP3SENP8SENP7 | |
| SCHEMBL25866687 | 0.82 | SMN1; SMN2 (0.65) | RAB9ANPC1CASP3SENP8SENP7 | |
| SCHEMBL609984 | 0.81 | KDM4E (0.54) | RAB9ANPC1CASP3SENP8SENP7 | |
| SCHEMBL4728732 | 0.81 | RAB9A (0.55) | RAB9ANPC1CASP3SENP8SENP7 | |
| SCHEMBL4386607 | 0.80 | RAB9A (0.74) | RAB9ANPC1CASP3SENP8SENP7 | |
| SCHEMBL4434197 | 0.79 | MDM2 (0.67) | RAB9ANPC1CASP3SENP8SENP7 | |
| SCHEMBL31339958 | 0.78 | RAB9A (0.60) | RAB9ANPC1CASP3SENP8SENP7 | |
| SCHEMBL31220216 | 0.78 | RAB9A (0.54) | RAB9ANPC1CASP3SENP8SENP7 | |
| SCHEMBL29678523 | 0.77 | RAB9A (0.59) | RAB9ANPC1CASP3SENP8SENP7 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008034579-A1 | 2-HETEROCYCLYL-5-PHENOXYMETHYLPYRIDINE DERIVATIVES AS ANTICANCER AGENTS | F. HOFFMANN-LA ROCHE AG (CH) | 2008-03-27 | — | — | WO | disclosed |