Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.50 |
| ▸ | POLB | P06746 | 4/20 | 0.50 |
| ▸ | RAB9A | P51151 | 4/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | ESR1 | P03372 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | JMJD7 | P0C870 | 1/20 | 0.50 |
| ▸ | STAT3 | P40763 | 1/20 | 0.50 |
| ▸ | STAT1 | P42224 | 1/20 | 0.50 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | GFER | P55789 | 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 | |
|---|---|---|---|---|
| SCHEMBL27547515 | 0.82 | GAA (0.54) | KDM4EPOLBRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL6360616 | 0.81 | GSK3B (0.53) | KDM4EPOLBRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL1587164 | 0.81 | KDM4E (0.51) | KDM4EPOLBRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL12124267 | 0.81 | POLB (0.65) | KDM4EPOLBRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL6362085 | 0.79 | GAA (0.75) | KDM4EPOLBRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL12313385 | 0.79 | RAB9A (0.60) | KDM4EPOLBRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL6977403 | 0.79 | KDM4E (0.50) | KDM4EPOLBRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL6362178 | 0.79 | MAPK1 (0.69) | KDM4EPOLBRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL2001834 | 0.78 | NPSR1 (0.50) | KDM4EPOLBRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL6978678 | 0.78 | KDM4E (0.49) | KDM4EPOLBRAB9ANPC1SMN1; SMN2 |
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-2009137081-A2 | SMALL MOLECULE INHIBITORS OF PLASMODIUM FALCIPARUM DIHYDROOROTATE DEHYDROGENASE | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2009-11-12 | — | — | WO | disclosed |