Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 3/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | CASP3 | P42574 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL12880107 | 0.88 | MEN1 (0.41) | TDP1ALDH1A1GAAPOLBCASP3 | |
| SCHEMBL13026882 | 0.80 | TDP1 (0.51) | TDP1ALDH1A1GAAPOLBCASP3 | |
| SCHEMBL13026902 | 0.80 | TDP1 (0.51) | TDP1ALDH1A1GAAPOLBCASP3 | |
| SCHEMBL16984828 | 0.80 | NPSR1 (0.42) | ALDH1A1GAAPOLBTSHRKMT2A | |
| SCHEMBL1239675 | 0.77 | TDP1 (0.62) | TDP1ALDH1A1GAAPOLBL3MBTL1 | |
| SCHEMBL1239670 | 0.77 | TDP1 (0.62) | TDP1ALDH1A1GAAPOLBL3MBTL1 | |
| SCHEMBL16563079 | 0.75 | CA2 (0.45) | — | |
| SCHEMBL7439359 | 0.75 | TDP1 (0.53) | TDP1ALDH1A1GAAPOLBL3MBTL1 | |
| SCHEMBL3444482 | 0.74 | ALDH1A1 (0.60) | ALDH1A1GAAPOLBL3MBTL1SMN1; SMN2 | |
| SCHEMBL3444977 | 0.72 | ALDH1A1 (0.61) | TDP1ALDH1A1GAAPOLBL3MBTL1 |
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-1523493-B1 | NOVEL TUBULYSIN ANALOGUES | DOEMLING ALEXANDER (DE) | 2013-09-04 | — | — | EP | disclosed |
| US-7816377-B2 | Tubulysin analogues | R&D-BIOPHARMACEUTICALS GMBH (DE) | 2010-10-19 | — | — | US | disclosed |