Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 5/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.67 |
| ▸ | MAPT | P10636 | 4/20 | 0.67 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.67 |
| ▸ | POLB | P06746 | 2/20 | 0.67 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.67 |
| ▸ | VCP | P55072 | 1/20 | 0.67 |
| ▸ | KDR | P35968 | 3/20 | 0.50 |
| ▸ | GSK3B | P49841 | 2/20 | 0.47 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.46 |
| ▸ | IDO1 | P14902 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 6/20 | 0.45 |
| ▸ | NPC1 | O15118 | 5/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.45 |
| ▸ | MAP2K7 | O14733 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CDC25B | P30305 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4408999 | 1.00 | MEN1 (0.67) | MEN1KMT2AMAPTL3MBTL1POLB | |
| SCHEMBL4409453 | 0.90 | MAPT (0.60) | MEN1KMT2AMAPTL3MBTL1POLB | |
| SCHEMBL4409457 | 0.90 | MAPT (0.60) | MEN1KMT2AMAPTL3MBTL1POLB | |
| SCHEMBL6941860 | 0.86 | KDR (0.53) | MEN1KMT2AMAPTL3MBTL1POLB | |
| SCHEMBL7263628 | 0.86 | KDR (0.53) | MEN1KMT2AMAPTL3MBTL1POLB | |
| SCHEMBL4895014 | 0.85 | KMT2A (0.52) | MEN1KMT2AMAPTL3MBTL1POLB | |
| SCHEMBL4895008 | 0.85 | KMT2A (0.52) | MEN1KMT2AMAPTL3MBTL1POLB | |
| SCHEMBL19678415 | 0.84 | LRRK2 (0.58) | MEN1KMT2APOLBKDRLRRK2 | |
| SCHEMBL3993251 | 0.84 | LRRK2 (0.58) | MEN1KMT2APOLBKDRLRRK2 | |
| SCHEMBL9661928 | 0.84 | LRRK2 (0.58) | MEN1KMT2APOLBKDRLRRK2 |
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-2009135000-A2 | INHIBITION OF SHP2/PTPN11 PROTEIN TYROSINE PHOSPHATASE BY NSC-117199 AND ANALOGS | H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) | 2009-11-05 | — | — | WO | disclosed |