Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.31 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL13951315 | 0.83 | ALDH1A1 (0.37) | ALDH1A1LMNAHSD17B10TSHR | |
| SCHEMBL22621253 | 0.82 | TSHR (0.38) | ALDH1A1CES2CES1FFAR3HDAC3 | |
| SCHEMBL19882382 | 0.82 | ALDH1A1 (0.41) | ALDH1A1CES2CES1FFAR3HDAC3 | |
| SCHEMBL22043673 | 0.79 | ALDH1A1 (0.30) | ALDH1A1 | |
| SCHEMBL19003436 | 0.79 | NPSR1 (0.36) | ALDH1A1LMNAHSD17B10TSHR | |
| SCHEMBL14535262 | 0.79 | ALDH1A1 (0.36) | ALDH1A1HSD17B10CES2CES1FFAR3 | |
| SCHEMBL21011837 | 0.78 | TSHR (0.45) | ALDH1A1LMNAHSD17B10TSHR | |
| SCHEMBL14529798 | 0.78 | — | — | |
| SCHEMBL21541035 | 0.78 | ALDH1A1 (0.34) | ALDH1A1CES2CES1FFAR3HDAC3 | |
| SCHEMBL13760104 | 0.77 | CYP2C19 (0.30) | — |
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-1569694-B1 | POLYAMINE CONJUGATES WITH ACIDIC RETINOIDS AND PREPARATION THEREOF | PAPAIOANNOU DIONYSIOS (GR) | 2009-11-25 | — | — | EP | disclosed |
| EP-1029016-B1 | NOVEL CHEMILUMINESCENT LABELING COMPOUNDS | LUMIGEN INC (US) | 2007-03-07 | — | — | EP | disclosed |