Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACSS2 | Q9NR19 | 1/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | SLC13A5 | Q86YT5 | 1/20 | 0.33 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.33 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.33 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | TNF | P01375 | 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 | |
|---|---|---|---|---|
| SCHEMBL19330160 | 0.82 | MEN1 (0.39) | ACSS2MTNR1AALDH1A1MAPTSLC13A5 | |
| SCHEMBL30701188 | 0.82 | MEN1 (0.39) | ACSS2MTNR1AALDH1A1MAPTSLC13A5 | |
| SCHEMBL5069502 | 0.81 | ALDH1A1 (0.35) | ACSS2MTNR1AALDH1A1MAPTSLC13A5 | |
| SCHEMBL29138536 | 0.78 | SLC13A5 (0.51) | ALDH1A1SLC13A5MAOA | |
| SCHEMBL19330347 | 0.75 | HPGD (0.34) | ACSS2MTNR1AALDH1A1MAPTSLC13A5 | |
| SCHEMBL6645213 | 0.73 | HSD17B10 (0.41) | MTNR1AALDH1A1MAPTSLC13A5 | |
| SCHEMBL5072695 | 0.73 | CYP3A4 (0.42) | ACSS2MTNR1AALDH1A1MAPTSLC13A5 | |
| SCHEMBL25297854 | 0.70 | TNKS2 (0.39) | MTNR1ATUBB1TNKS2CYP4A11 | |
| SCHEMBL4774241 | 0.70 | AOC3 (0.56) | ALDH1A1MAPTTUBB1TNKS2 | |
| SCHEMBL23964582 | 0.69 | PTGER4 (0.43) | ALDH1A1TNKS2CYP4A11 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2007386-A2 | CAMPTOTHECIN-ANALOG WITH A NOVEL, FLIPPED LACTONE-STABLE, E-RING AND METHODS FOR MAKING AND USING SAME | BIONUMERIK PHARMACEUTICALS, INC. (US) | 2008-12-31 | — | — | EP | disclosed |
| WO-2007123995-A2 | CAMPTOTHECIN-ANALOG WITH A NOVEL, “FLIPPED” LACTONE-STABLE, E-RING AND METHODS FOR MAKING AND USING SAME | BIONUMERIK PHARMACEUTICALS, INC. (US) | 2007-11-01 | — | — | WO | disclosed |