Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APEX1 | P27695 | 3/20 | 0.49 |
| ▸ | AURKA | O14965 | 1/20 | 0.45 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.45 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.44 |
| ▸ | SENP2 | Q9HC62 | 7/20 | 0.42 |
| ▸ | SUMO2 | P61956 | 5/20 | 0.42 |
| ▸ | SUMO1 | P63165 | 5/20 | 0.42 |
| ▸ | SENP7 | Q9BQF6 | 5/20 | 0.42 |
| ▸ | ATIC | P31939 | 1/20 | 0.42 |
| ▸ | SENP1 | Q9P0U3 | 5/20 | 0.41 |
| ▸ | SENP3 | Q9H4L4 | 4/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | THRB | P10828 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11847983 | 1.00 | APEX1 (0.49) | APEX1AURKAAURKBENPP2SENP2 | |
| SCHEMBL11849768 | 0.79 | APEX1 (0.60) | APEX1ENPP2SENP2SUMO2SUMO1 | |
| SCHEMBL11849783 | 0.79 | APEX1 (0.60) | APEX1ENPP2SENP2SUMO2SUMO1 | |
| SCHEMBL11683758 | 0.78 | SENP2 (0.51) | APEX1AURKAAURKBSENP2SUMO2 | |
| SCHEMBL11670482 | 0.77 | APEX1 (0.73) | APEX1ENPP2SENP2SUMO2SUMO1 | |
| SCHEMBL6346835 | 0.77 | APEX1 (0.73) | APEX1ENPP2SENP2SUMO2SUMO1 | |
| SCHEMBL11670965 | 0.77 | APEX1 (0.73) | APEX1ENPP2SENP2SUMO2SUMO1 | |
| SCHEMBL11670471 | 0.76 | APEX1 (0.72) | APEX1ENPP2SENP2SUMO2SUMO1 | |
| SCHEMBL11190972 | 0.76 | ENPP2 (0.59) | APEX1AURKAAURKBENPP2CYP1A2 | |
| SCHEMBL11190957 | 0.76 | ENPP2 (0.59) | APEX1AURKAAURKBENPP2CYP1A2 |
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-3998957-A | 1,1'-(UREYLENEBIS(SULFO-P-PHENYLENE)BISSULFO-1H,8H-INDAZOLO(2,3,4-CDE)BENZOTRIAZOL-9-IUM HYDROXIDE)INNER SALT | AMERICAN CYANAMID COMPANY (US) | 1976-12-21 | — | — | US | disclosed |