Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP2A | P11388 | 2/20 | 0.68 |
| ▸ | CTH | P32929 | 1/20 | 0.66 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.62 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.59 |
| ▸ | NPC1 | O15118 | 5/20 | 0.59 |
| ▸ | RAB9A | P51151 | 5/20 | 0.59 |
| ▸ | LMNA | P02545 | 3/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.57 |
| ▸ | HTT | P42858 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.55 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.54 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL2562207 | 1.00 | TOP2A (0.68) | TOP2ACTHADORA2AHKDC1NPC1 | |
| SCHEMBL31690655 | 0.86 | TOP2A (0.82) | TOP2ACTHADORA2AHKDC1NPC1 | |
| SCHEMBL293101 | 0.83 | TOP2A (0.68) | TOP2ACTHADORA2AHKDC1NPC1 | |
| SCHEMBL534248 | 0.83 | TOP2A (0.68) | TOP2ACTHADORA2AHKDC1NPC1 | |
| SCHEMBL3059864 | 0.81 | NPC1 (0.68) | TOP2ACTHADORA2AHKDC1NPC1 | |
| SCHEMBL31690665 | 0.81 | TOP2A (0.73) | TOP2ACTHADORA2AHKDC1NPC1 | |
| SCHEMBL13611503 | 0.81 | TOP2A (1.00) | TOP2ACTHADORA2AHKDC1NPC1 | |
| SCHEMBL1982234 | 0.80 | CTH (1.00) | TOP2ACTHADORA2ALMNAMEN1 | |
| SCHEMBL1982233 | 0.80 | CTH (1.00) | TOP2ACTHADORA2ALMNAMEN1 | |
| SCHEMBL14517019 | 0.79 | RAB9A (0.71) | TOP2ACTHNPC1RAB9ALMNA |
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-2011132030-A1 | A METHOD OF SYNTHESIZING A COMPLEX [MN (NNS)2] ACTIVE AGAINST THE MALARIA PARASITE PLASMODIUM FALCIPARUM | UNIVERSITY OF NAMIBIA (NA) | 2011-10-27 | — | — | WO | disclosed |