Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 1/20 | 0.45 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 1/20 | 0.40 |
| ▸ | HPGDS | O60760 | 1/20 | 0.39 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 5/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.37 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.36 |
| ▸ | FEN1 | P39748 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL73892 | 0.83 | DAO (0.45) | DAOCES2CES1KIF11HPGDS | |
| Fluoride SCHEMBL14940050 | 0.81 | DAO (0.43) | DAOCES2CES1KIF11HPGDS | |
| Bromide SCHEMBL16713401 | 0.81 | DAO (0.43) | DAOCES2CES1KIF11HPGDS | |
| SCHEMBL1827117 | 0.79 | DAO (0.42) | DAOCES2CES1KIF11HPGDS | |
| SCHEMBL10670693 | 0.78 | DAO (0.45) | DAOCES2CES1KIF11HPGDS | |
| Bromomethane SCHEMBL5389919 | 0.78 | CHRM3 (0.41) | DAOCES2CES1KIF11HPGDS | |
| Iodomethane SCHEMBL6402613 | 0.78 | CHRM3 (0.41) | DAOCES2CES1KIF11HPGDS | |
| SCHEMBL599752 | 0.77 | DAO (0.43) | DAOCES2CES1KIF11HPGDS | |
| SCHEMBL1492740 | 0.77 | DAO (0.43) | DAOCES2CES1KIF11HPGDS | |
| SCHEMBL73588 | 0.77 | DAO (0.43) | DAOCES2CES1KIF11HPGDS |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1058011-C | 13-substituted milbemycin derivatives, their preparation and use | SANKYO CO (JP) | 2000-11-01 | — | — | CN | disclosed |
| CN-1112119-A | 13-substituted milbemycin derivatives, their preparation and use | SANKYO CO (JP) | 1995-11-22 | — | — | CN | disclosed |