Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK1 | P53350 | 1/20 | 0.67 |
| ▸ | CA12 | O43570 | 1/20 | 0.59 |
| ▸ | CA1 | P00915 | 1/20 | 0.59 |
| ▸ | CA2 | P00918 | 1/20 | 0.59 |
| ▸ | CA9 | Q16790 | 1/20 | 0.59 |
| ▸ | RAB9A | P51151 | 5/20 | 0.56 |
| ▸ | LMNA | P02545 | 3/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.56 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.56 |
| ▸ | RELA | Q04206 | 1/20 | 0.56 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 4/20 | 0.55 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.49 |
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8792955 | 0.98 | PLK1 (0.65) | PLK1CA12CA1CA2CA9 | |
| SCHEMBL27574154 | 0.86 | PLK1 (0.71) | PLK1CA12CA1CA2CA9 | |
| SCHEMBL7445617 | 0.85 | PLK1 (0.51) | PLK1CA12CA1CA2CA9 | |
| SCHEMBL7554080 | 0.85 | PLK1 (0.55) | PLK1CA12CA1CA2CA9 | |
| SCHEMBL5316479 | 0.85 | NPC1 (0.54) | PLK1CA12CA1CA2CA9 | |
| Hydrochloric Acid SCHEMBL38666104 | 0.84 | HTR1D (0.52) | PLK1CA12CA1CA2CA9 | |
| SCHEMBL25463237 | 0.84 | PLK1 (0.69) | PLK1CA12CA1CA2CA9 | |
| SCHEMBL326978 | 0.84 | PLK1 (0.69) | PLK1CA12CA1CA2CA9 | |
| SCHEMBL30509227 | 0.83 | RAB9A (0.53) | PLK1CA12CA1CA2CA9 | |
| SCHEMBL13415301 | 0.83 | L3MBTL1 (0.69) | PLK1CA12CA1CA2CA9 |
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-7109243-B2 | Inhibitors of cathepsin S | IRM LLC (BM) | 2006-09-19 | — | — | US | disclosed |