Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP2A | P11388 | 3/20 | 0.47 |
| ▸ | TOP2B | Q02880 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | PTAFR | P25105 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10365364 | 0.83 | TOP2A (0.47) | TOP2ATOP2BCYP1A2CYP2D6MEN1 | |
| SCHEMBL9207860 | 0.83 | TOP2A (0.66) | TOP2ATOP2BCYP1A2CYP2D6MEN1 | |
| SCHEMBL11135297 | 0.81 | CYP2D6 (0.45) | TOP2ATOP2BCYP1A2CYP2D6KMT2A | |
| SCHEMBL11135067 | 0.80 | TOP2A (0.48) | TOP2ATOP2BCYP1A2CYP2D6MEN1 | |
| SCHEMBL2898647 | 0.80 | TOP2A (0.44) | TOP2ATOP2BCYP1A2CYP2D6MEN1 | |
| SCHEMBL7561044 | 0.79 | TOP2A (0.47) | TOP2ATOP2BMEN1KMT2ANPC1 | |
| SCHEMBL7118380 | 0.79 | TOP2A (0.66) | TOP2ATOP2BMEN1KMT2APTAFR | |
| SCHEMBL11134767 | 0.78 | MEN1 (0.47) | TOP2ATOP2BCYP1A2CYP2D6MEN1 | |
| SCHEMBL11135109 | 0.78 | MAPT (0.60) | TOP2ATOP2BMEN1KMT2ARECQL | |
| SCHEMBL11137789 | 0.78 | MEN1 (0.47) | TOP2ATOP2BCYP1A2CYP2D6MEN1 |
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-105859626-A | Dithiocyanodiimidazoline bactericidal corrosion inhibitor, and preparation method and application thereof | 广东工业大学 | 2016-08-17 | — | — | CN | disclosed |