Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 6/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.40 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.40 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7950460 | 0.81 | HDAC1 (0.46) | RAB9ANPC1CA12CA1CA9 | |
| SCHEMBL7666786 | 0.80 | RAB9A (0.46) | KDM4ERAB9AKMT2ANPC1MEN1 | |
| SCHEMBL7938992 | 0.80 | L3MBTL1 (0.44) | GAAL3MBTL1RAB9AKMT2ANPC1 | |
| SCHEMBL6819653 | 0.80 | KDM4E (0.48) | KDM4EL3MBTL1RAB9AKMT2ANPC1 | |
| SCHEMBL7945599 | 0.77 | RAB9A (0.61) | GAAL3MBTL1RAB9AKMT2ANPC1 | |
| SCHEMBL6815733 | 0.76 | PLAU (0.48) | GAAL3MBTL1RAB9AKMT2ANPC1 | |
| SCHEMBL6815400 | 0.75 | LMNA (0.49) | KDM4EL3MBTL1RAB9AKMT2ANPC1 | |
| SCHEMBL6816818 | 0.75 | MAPT (0.48) | GAAL3MBTL1RAB9AKMT2ANPC1 | |
| SCHEMBL6819683 | 0.74 | SMN1; SMN2 (0.47) | KDM4ERAB9AKMT2ANPC1MEN1 | |
| SCHEMBL7945400 | 0.74 | SMN1; SMN2 (0.41) | KDM4EL3MBTL1RAB9AKMT2ANPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6262082-B1 | Diaminopyridine-containing thiourea inhibitors of herpes viruses | WYETH | 2001-07-17 | — | — | US | disclosed |