Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | HPGD | P15428 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | KDM6B | O15054 | 1/20 | 0.45 |
| ▸ | KDM4A | O75164 | 1/20 | 0.45 |
| ▸ | KDM5C | P41229 | 1/20 | 0.45 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.45 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.45 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | CRHBP | P24387 | 1/20 | 0.44 |
| ▸ | CRHR2 | Q13324 | 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 | |
|---|---|---|---|---|
| SCHEMBL2563543 | 0.81 | ALDH1A1 (0.51) | ALDH1A1HPGDKDM4ETSHRMAPK1 | |
| SCHEMBL10144182 | 0.77 | HPGD (0.45) | ALDH1A1HPGDKDM4ETSHRMAPK1 | |
| SCHEMBL10408359 | 0.76 | KMT2A (0.56) | ALDH1A1HPGDKDM4ETSHRMAPK1 | |
| SCHEMBL2872971 | 0.75 | ALDH1A1 (0.46) | ALDH1A1HPGDKDM4ETSHRMAPK1 | |
| SCHEMBL9536836 | 0.75 | KCNH3 (0.47) | ALDH1A1HPGDKDM4ETSHRMAPK1 | |
| SCHEMBL875144 | 0.74 | HSD17B10 (0.58) | ALDH1A1HPGDKDM4ETSHRLMNA | |
| SCHEMBL1742362 | 0.73 | AURKA (0.56) | ALDH1A1HPGDKDM4ETSHRMAPK1 | |
| SCHEMBL453628 | 0.73 | KDM4E (0.68) | ALDH1A1HPGDKDM4ETSHRMAPK1 | |
| SCHEMBL22129250 | 0.72 | KDM4E (0.57) | ALDH1A1HPGDKDM4ETSHRMAPK1 | |
| SCHEMBL9698164 | 0.72 | MAPT (0.63) | ALDH1A1HPGDMAPK1LMNAGAA |
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 |
|---|---|---|---|---|---|---|---|
| US-8143288-B2 | Inhibitors of HCV replication | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-03-27 | — | — | US | disclosed |