Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 13/20 | 0.40 |
| ▸ | RAB9A | P51151 | 12/20 | 0.40 |
| ▸ | NPC1 | O15118 | 11/20 | 0.40 |
| ▸ | TP53 | P04637 | 11/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 8/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.40 |
| ▸ | RELA | Q04206 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 5/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL808211 | 0.88 | RPS6KA2 (0.33) | SMN1; SMN2RAB9ANPC1TP53ALDH1A1 | |
| SCHEMBL10287187 | 0.84 | ALDH1A1 (0.45) | SMN1; SMN2RAB9ANPC1TP53ALDH1A1 | |
| SCHEMBL808347 | 0.82 | HCRTR1 (0.34) | ALDH1A1HSD17B10MEN1KMT2AHPGD | |
| SCHEMBL808333 | 0.80 | NPC1 (0.37) | SMN1; SMN2RAB9ANPC1ALDH1A1MEN1 | |
| SCHEMBL808229 | 0.79 | SIGMAR1 (0.32) | — | |
| SCHEMBL808221 | 0.79 | SIGMAR1 (0.32) | — | |
| SCHEMBL808235 | 0.78 | HDAC6 (0.34) | RAB9ANPC1NFKB1NFKB2RELA | |
| SCHEMBL807993 | 0.78 | GRM5 (0.39) | SMN1; SMN2RAB9ANPC1TP53NFKB1 | |
| SCHEMBL808224 | 0.78 | SIGMAR1 (0.32) | — | |
| SCHEMBL807994 | 0.78 | SIGMAR1 (0.31) | — |
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-2012035023-A1 | TRIAZINE-OXADIAZOLES | NOVARTIS AG (CH) | 2012-03-22 | — | — | WO | disclosed |