Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | CES1 | P23141 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | DAO | P14920 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL18032724 | 0.81 | TDP1 (0.36) | TDP1ALDH1A1MAPK1HSP90AA1SMN1; SMN2 | |
| SCHEMBL1283 | 0.78 | TDP1 (0.52) | TDP1ALDH1A1MAPK1SMN1; SMN2HPGD | |
| SCHEMBL18227905 | 0.76 | CES1 (0.39) | TDP1ALDH1A1MAPK1SMN1; SMN2HPGD | |
| SCHEMBL7715841 | 0.74 | CES1 (0.43) | ALDH1A1MAPK1CES1MEN1CYP3A4 | |
| SCHEMBL27557184 | 0.72 | ALDH1A1 (0.43) | TDP1ALDH1A1MAPK1SMN1; SMN2HPGD | |
| SCHEMBL29875319 | 0.72 | ALDH1A1 (0.41) | ALDH1A1MAPK1HSP90AA1SMN1; SMN2HPGD | |
| SCHEMBL27618222 | 0.72 | MAPK1 (0.37) | TDP1ALDH1A1MAPK1SMN1; SMN2HPGD | |
| Thiobenzoic Acid SCHEMBL28633716 | 0.72 | ALDH1A1 (0.38) | TDP1ALDH1A1MAPK1HSP90AA1SMN1; SMN2 | |
| Dimethylamine SCHEMBL28118187 | 0.72 | KMT2A (0.50) | TDP1ALDH1A1MAPK1SMN1; SMN2HPGD | |
| SCHEMBL27562513 | 0.72 | MAPK1 (0.41) | TDP1ALDH1A1MAPK1HSP90AA1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0226896-A2 | Lankacidin derivatives and production thereof | Takeda Chemical Industries, Ltd. (JP) | 1987-07-01 | — | — | EP | disclosed |