Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.46 |
| ▸ | USP2 | O75604 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL21683001 | 0.97 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2HSD17B10KDM4EGAA | |
| SCHEMBL21701579 | 0.90 | SMN1; SMN2 (0.53) | ALDH1A1SMN1; SMN2HSD17B10KDM4EGAA | |
| SCHEMBL21701591 | 0.86 | SMN1; SMN2 (0.55) | ALDH1A1SMN1; SMN2HSD17B10KDM4EGAA | |
| SCHEMBL21701594 | 0.80 | F10 (0.57) | ALDH1A1SMN1; SMN2GAAKMT2AMAPT | |
| SCHEMBL21701474 | 0.79 | SMN1; SMN2 (0.58) | ALDH1A1SMN1; SMN2HSD17B10KDM4EGAA | |
| SCHEMBL21683033 | 0.77 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2HSD17B10KDM4EGAA | |
| SCHEMBL21701581 | 0.77 | POLB (0.56) | ALDH1A1SMN1; SMN2HSD17B10KDM4EKMT2A | |
| SCHEMBL21683032 | 0.70 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2HSD17B10KDM4EGAA | |
| SCHEMBL15528812 | 0.68 | MAPK1 (0.71) | ALDH1A1SMN1; SMN2HSD17B10KDM4EGAA | |
| SCHEMBL21701478 | 0.68 | CYP1A2 (0.61) | ALDH1A1SMN1; SMN2HSD17B10KDM4EGAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020033944-A2 | NON-POLYAMINE BASED POLYAMINE TRANSPORT INHIBITORS AND THEIR USE IN THE TREATMENT OF HUMAN CANCERS | UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) | 2020-02-13 | — | — | WO | disclosed |