Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 11/20 | 0.64 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.64 |
| ▸ | MEN1 | O00255 | 1/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.64 |
| ▸ | TSHR | P16473 | 3/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 3/20 | 0.48 |
| ▸ | USP2 | O75604 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | IDH2 | P48735 | 1/20 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL342591 | 0.95 | KDM4E (0.57) | KDM4EHSD17B10ALDH1A1MEN1KMT2A | |
| Trifluoroacetic Acid SCHEMBL341448 | 0.95 | KDM4E (0.57) | KDM4EHSD17B10ALDH1A1MEN1KMT2A | |
| SCHEMBL14670299 | 0.87 | HSD17B10 (0.48) | KDM4EHSD17B10ALDH1A1MEN1KMT2A | |
| SCHEMBL14670320 | 0.87 | HSD17B10 (0.48) | KDM4EHSD17B10ALDH1A1MEN1KMT2A | |
| SCHEMBL342592 | 0.85 | KDM4E (0.45) | KDM4EHSD17B10ALDH1A1MEN1KMT2A | |
| SCHEMBL341449 | 0.85 | KDM4E (0.45) | KDM4EHSD17B10ALDH1A1MEN1KMT2A | |
| SCHEMBL341758 | 0.84 | KDM4E (0.43) | KDM4EHSD17B10ALDH1A1MEN1KMT2A | |
| SCHEMBL341759 | 0.84 | KDM4E (0.43) | KDM4EHSD17B10ALDH1A1MEN1KMT2A | |
| SCHEMBL341757 | 0.84 | KDM4E (0.43) | KDM4EHSD17B10ALDH1A1MEN1KMT2A | |
| SCHEMBL474612 | 0.83 | KDM4E (0.41) | KDM4EHSD17B10ALDH1A1MEN1KMT2A |
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-2411011-A1 | NOVEL AMINOPYRIDINE DERIVATIVES HAVING AURORA A SELECTIVE INHIBITORY ACTION | MSD K.K. (JP) | 2012-02-01 | — | — | EP | disclosed |
| WO-2010111056-A1 | NOVEL AMINOPYRIDINE DERIVATIVES HAVING AURORA A SELECTIVE INHIBITORY ACTION | BANYU PHARMACEUTICAL CO., LTD. (JP) | 2010-09-30 | — | — | WO | disclosed |