Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | METAP2 | P50579 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | METAP1 | P53582 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | KDM4A | O75164 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL27745785 | 0.72 | KDM4E (0.34) | KDM4ELMNAMAPTMETAP1PKM | |
| SCHEMBL18335244 | 0.72 | METAP1 (0.43) | KDM4ELMNAMAPTMETAP1PKM | |
| SCHEMBL28865660 | 0.69 | CDK2 (0.40) | KDM4ELMNAPKMTSHRALDH1A1 | |
| SCHEMBL3131793 | 0.69 | CHEK1 (0.35) | KDM4ELMNAMAPTMETAP1PKM | |
| SCHEMBL12614645 | 0.69 | NPC1 (0.39) | KDM4ELMNAPKMTSHRALDH1A1 | |
| SCHEMBL27794438 | 0.67 | PIK3CA (0.39) | KDM4ELMNAL3MBTL1PIK3CAMTOR | |
| SCHEMBL27760171 | 0.67 | KMT2A (0.44) | LMNAMETAP2MAPTMETAP1ALDH1A1 | |
| SCHEMBL1633833 | 0.67 | CDK2 (0.60) | BRD4 | |
| SCHEMBL6100741 | 0.66 | FGFR1 (0.40) | KDM4ELMNAMAPTMETAP1PKM | |
| SCHEMBL27801283 | 0.66 | HTT (0.39) | KDM4EMAPTALDH1A1KMT2AL3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101454294-A | Quinazolines for pdk1 inhibition | NOVARTIS AG (CH) | 2009-06-10 | — | — | CN | disclosed |