Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | CES1 | P23141 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 3/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | CA1 | P00915 | 2/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | GSK3B | P49841 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8021776 | 1.00 | TDP1 (0.55) | TDP1CES1KMT2AMAPTALDH1A1 | |
| SCHEMBL10792016 | 0.79 | TSHR (0.52) | TDP1CES1KMT2AMAPTALDH1A1 | |
| SCHEMBL28587201 | 0.79 | ALDH1A1 (0.56) | TDP1CES1KMT2AMAPTALDH1A1 | |
| SCHEMBL7208394 | 0.79 | GSK3B (0.65) | TDP1CES1KMT2AMAPTALDH1A1 | |
| SCHEMBL17973372 | 0.78 | MAPK1 (0.47) | TDP1CES1KMT2AMAPTALDH1A1 | |
| SCHEMBL6924258 | 0.78 | KMT2A (0.60) | KMT2AMAPTALDH1A1MEN1GAA | |
| SCHEMBL6924260 | 0.78 | KMT2A (0.60) | KMT2AMAPTALDH1A1MEN1GAA | |
| SCHEMBL28552872 | 0.75 | CES1 (0.46) | TDP1CES1MAPTALDH1A1GAA | |
| SCHEMBL28552870 | 0.75 | CES1 (0.46) | TDP1CES1MAPTALDH1A1GAA | |
| SCHEMBL8017793 | 0.74 | TDP1 (0.60) | TDP1CES1KMT2AALDH1A1MEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0675133-B1 | 13-Substituted milbemycin derivatives, their preparation and use | SANKYO CO (JP) | 2000-01-12 | — | — | EP | disclosed |
| US-5614470-A | AGRICULTURAL ANTHELMINTIC, ACARICIDE, INSECTICIDE | SANKYO COMPANY, LIMITED (JP) | 1997-03-25 | — | — | US | disclosed |
| EP-0675133-A1 | 13-Substituted milbemycin derivatives, their preparation and use | SANKYO COMPANY LIMITED (JP) | 1995-10-04 | — | — | EP | disclosed |