Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 13/20 | 0.38 |
| ▸ | HPGD | P15428 | 9/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.38 |
| ▸ | MAPT | P10636 | 6/20 | 0.38 |
| ▸ | MEN1 | O00255 | 5/20 | 0.38 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 12/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.34 |
| ▸ | PKM | P14618 | 3/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3088342 | 0.89 | ALDH1A1 (0.51) | ALDH1A1HPGDKMT2AMAPTMEN1 | |
| SCHEMBL3654142 | 0.88 | EEF2K (0.39) | ALDH1A1HPGDKMT2AMAPTMEN1 | |
| SCHEMBL14312146 | 0.86 | EEF2K (0.40) | ALDH1A1HPGDKMT2AMAPTMEN1 | |
| SCHEMBL3647532 | 0.81 | BRAF (0.46) | ALDH1A1HPGDKMT2AMAPTMEN1 | |
| SCHEMBL3409644 | 0.80 | MEN1 (0.36) | ALDH1A1HPGDKMT2AMAPTMEN1 | |
| SCHEMBL3656735 | 0.78 | MAPT (0.39) | ALDH1A1HPGDKMT2AMAPTMEN1 | |
| SCHEMBL3081937 | 0.77 | EEF2K (0.51) | ALDH1A1HPGDKMT2AMAPTMEN1 | |
| SCHEMBL3655988 | 0.77 | ALDH1A1 (0.36) | ALDH1A1HPGDKMT2AMAPTMEN1 | |
| SCHEMBL3656598 | 0.77 | EEF2K (0.41) | ALDH1A1HPGDKMT2AMEN1GAA | |
| SCHEMBL3089430 | 0.75 | EEF2K (0.51) | ALDH1A1HPGDKMT2AMAPTMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2197886-A1 | 5-CYANO-THIENOPYRIDINES FOR THE TREATMENT OF TUMORS | Merck Patent GmbH (DE) | 2010-06-23 | — | — | EP | claimed |
| WO-2009049743-A1 | 5-CYANO-THIENOPYRIDINES FOR THE TREATMENT OF TUMORS | MERCK PATENT GMBH (DE) | 2009-04-23 | — | — | WO | claimed |