Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 15/20 | 0.58 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28220311 | 0.89 | ALDH1A1 (0.50) | KIF11ALDH1A1TSHR | |
| SCHEMBL29914837 | 0.84 | KIF11 (0.78) | KIF11MAOBCA1CA2ALDH1A1 | |
| SCHEMBL197238 | 0.84 | KIF11 (0.78) | KIF11MAOBCA1CA2ALDH1A1 | |
| SCHEMBL13410633 | 0.84 | KIF11 (0.78) | KIF11MAOBCA1CA2ALDH1A1 | |
| SCHEMBL2089685 | 0.77 | KIF11 (0.61) | KIF11MAOBCA1CA2ALDH1A1 | |
| SCHEMBL12937177 | 0.76 | KIF11 (0.67) | KIF11MAOBCA1CA2ALDH1A1 | |
| SCHEMBL63468 | 0.74 | ALDH1A1 (0.67) | KIF11ALDH1A1TSHR | |
| SCHEMBL7940597 | 0.74 | KIF11 (0.64) | KIF11MAOBCA1CA2ALDH1A1 | |
| SCHEMBL163728 | 0.74 | KIF11 (1.00) | KIF11ALDH1A1TSHR | |
| SCHEMBL1044865 | 0.72 | KIF11 (0.61) | KIF11MAOBCA1CA2ALDH1A1 |
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-103145581-A | Aromatic diamine compound containing imide structure as well as preparation method and application thereof | UNIV SUN YAT SEN | 2013-06-12 | — | — | CN | disclosed |