Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP2 | P50579 | 1/20 | 0.42 |
| ▸ | TDO2 | P48775 | 2/20 | 0.39 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
| ▸ | KIF11 | P52732 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.33 |
| ▸ | PTGES | O14684 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19910985 | 0.71 | PPARG (0.41) | METAP2TDO2MAPK14ALDH1A1KDM4E | |
| SCHEMBL20043184 | 0.69 | TDO2 (0.44) | METAP2TDO2MAPK14KIF11ALDH1A1 | |
| SCHEMBL26522379 | 0.69 | NQO1 (0.47) | METAP2TDO2MAPK14ALDH1A1KDM4E | |
| SCHEMBL16160155 | 0.68 | MAPK14 (0.47) | METAP2TDO2MAPK14KIF11ALDH1A1 | |
| SCHEMBL2047967 | 0.68 | MAPT (0.52) | METAP2TDO2MAPK14ALDH1A1KDM4E | |
| SCHEMBL29363850 | 0.67 | ALDH1A1 (0.58) | METAP2TDO2SSTR5MAPK14KIF11 | |
| SCHEMBL756092 | 0.67 | ALDH1A1 (0.58) | METAP2TDO2SSTR5MAPK14KIF11 | |
| SCHEMBL10409091 | 0.67 | ALDH1A1 (0.54) | MAPK14KIF11ALDH1A1MAPTHPGD | |
| SCHEMBL19798858 | 0.67 | TDO2 (0.46) | METAP2TDO2MAPK14ALDH1A1KDM4E | |
| SCHEMBL11891545 | 0.67 | PTGES (0.46) | ALDH1A1KDM4EMAPTHPGDPTGES |
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-9624178-B2 | Substituted cyclopenta pyrimidine bicyclic compounds having antitmitotic and/or antitumor activity methods of use thereof | DUQUESNE UNIVERSITY OF THE HOLY SPIRIT (US) | 2017-04-18 | — | — | US | disclosed |