Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | PLK1 | P53350 | 1/20 | 0.46 |
| ▸ | TACR3 | P29371 | 1/20 | 0.46 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.44 |
| ▸ | MMP3 | P08254 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2408316 | 0.76 | HDAC1 (0.65) | ALDH1A1LMNAKMT2APLK1TACR3 | |
| SCHEMBL8737627 | 0.73 | PLK1 (0.66) | ALDH1A1LMNANPC1RAB9AKMT2A | |
| SCHEMBL735538 | 0.72 | PLK1 (0.57) | ALDH1A1LMNANPC1RAB9AKMT2A | |
| SCHEMBL25388151 | 0.72 | PLK1 (0.57) | ALDH1A1LMNANPC1RAB9AKMT2A | |
| SCHEMBL25386182 | 0.72 | PLK1 (0.57) | ALDH1A1LMNANPC1RAB9AKMT2A | |
| SCHEMBL12218397 | 0.71 | ALDH1A1 (0.65) | ALDH1A1LMNAPOLBPLK1TACR3 | |
| SCHEMBL887423 | 0.69 | PLK1 (0.53) | ALDH1A1LMNANPC1RAB9AKMT2A | |
| SCHEMBL9831213 | 0.69 | PLK1 (0.53) | ALDH1A1LMNANPC1RAB9AKMT2A | |
| SCHEMBL9831137 | 0.69 | PLK1 (0.60) | ALDH1A1LMNANPC1RAB9APLK1 | |
| SCHEMBL2405015 | 0.69 | PLK1 (0.60) | ALDH1A1LMNANPC1RAB9APLK1 |
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-1212309-B1 | CASPASE INHIBITOR | LG CHEM INVESTMENT LTD (KR) | 2004-08-18 | — | — | EP | disclosed |