Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | PIEZO1 | Q92508 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL19061884 | 0.83 | KMT2A (0.49) | ALDH1A1LMNASMN1; SMN2NPC1DRD2 | |
| SCHEMBL19061593 | 0.83 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2NPC1KDM4ETDP1 | |
| SCHEMBL19061459 | 0.81 | RAB9A (0.46) | ALDH1A1LMNASMN1; SMN2NPC1KDM4E | |
| SCHEMBL19061887 | 0.81 | L3MBTL1 (0.51) | LMNAL3MBTL1DRD2DRD4DRD3 | |
| SCHEMBL19019870 | 0.81 | CHRNB2 (0.43) | ALDH1A1LMNASMN1; SMN2NPC1KDM4E | |
| SCHEMBL19019834 | 0.81 | PLA2G7 (0.47) | ALDH1A1SMN1; SMN2NPC1DRD2DRD4 | |
| SCHEMBL19062035 | 0.81 | HSD17B10 (0.40) | ALDH1A1KDM4ETDP1MAPK1CYP3A4 | |
| SCHEMBL19019922 | 0.81 | MAPK1 (0.50) | ALDH1A1SMN1; SMN2KDM4ETDP1MAPK1 | |
| SCHEMBL19061952 | 0.81 | CYP1A2 (0.51) | SMN1; SMN2DRD2DRD4DRD3KDM4E | |
| SCHEMBL19062037 | 0.81 | METAP2 (0.43) | ALDH1A1L3MBTL1KDM4ETDP1MAPK1 |
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-3184514-A1 | AUTOPHAGY INHIBITORS | Deutsches Krebsforschungszentrum (DE) | 2017-06-28 | — | — | EP | disclosed |