Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 4/20 | 0.38 |
| ▸ | CES1 | P23141 | 4/20 | 0.38 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.38 |
| ▸ | ACKR3 | P25106 | 2/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.33 |
| ▸ | FEN1 | P39748 | 1/20 | 0.33 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.32 |
| ▸ | WNT3A | P56704 | 1/20 | 0.32 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.31 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14531212 | 0.81 | PTPN1 (0.41) | CES2CES1DGAT1ACKR3PTPN1 | |
| SCHEMBL19104747 | 0.81 | CES2 (0.61) | CES2CES1ACKR3RAB9A | |
| SCHEMBL31529633 | 0.81 | CES2 (0.61) | CES2CES1ACKR3RAB9A | |
| Hydrochloric Acid SCHEMBL30444188 | 0.79 | CES2 (0.59) | CES2CES1ACKR3 | |
| SCHEMBL28524236 | 0.79 | MAPT (0.41) | CES2CES1DGAT1ACKR3PTPN1 | |
| Hydrochloric Acid SCHEMBL19817282 | 0.79 | CES2 (0.59) | CES2CES1ACKR3 | |
| SCHEMBL2617372 | 0.78 | DGAT1 (0.65) | CES2CES1DGAT1PARP10PARP15 | |
| SCHEMBL5955284 | 0.78 | LOXL2 (0.48) | CES2CES1DGAT1NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL3248105 | 0.76 | CYP3A4 (0.46) | ACKR3ERCC5FEN1ALDH1A1MAPK1 | |
| SCHEMBL256756 | 0.76 | CES2 (0.43) | CES2CES1DGAT1PTPN1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007056056-A2 | MITOTIC KINESIN INHIBITORS | CYTOKINETICS, INC. (US) | 2007-05-18 | — | — | WO | disclosed |