Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 2/20 | 0.48 |
| ▸ | P2RY1 | P47900 | 2/20 | 0.42 |
| ▸ | PDE8A | O60658 | 2/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | CTSL | P07711 | 1/20 | 0.41 |
| ▸ | ELANE | P08246 | 1/20 | 0.41 |
| ▸ | CMA1 | P23946 | 1/20 | 0.41 |
| ▸ | CTSS | P25774 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5161430 | 0.88 | P2RX7 (0.46) | P2RX7P2RY1HDAC1HDAC2HDAC8 | |
| SCHEMBL183219 | 0.84 | HDAC1 (0.50) | P2RX7P2RY1HDAC6HDAC4HDAC1 | |
| SCHEMBL29444616 | 0.78 | CDK1 (0.51) | P2RX7HDAC6HDAC4HDAC1HDAC3 | |
| SCHEMBL183244 | 0.78 | CDK1 (0.51) | P2RX7HDAC6HDAC4HDAC1HDAC3 | |
| SCHEMBL3982080 | 0.78 | FDPS (0.69) | P2RX7P2RY1HDAC6HDAC4HDAC1 | |
| SCHEMBL5461215 | 0.77 | HDAC6 (0.60) | P2RX7HDAC6HDAC4HDAC1HDAC3 | |
| SCHEMBL12537292 | 0.76 | P2RX7 (0.47) | P2RX7P2RY1HDAC6HDAC4HDAC1 | |
| SCHEMBL3347915 | 0.76 | CTSL (0.70) | P2RY1HDAC6HDAC4HDAC1HDAC3 | |
| SCHEMBL30332411 | 0.75 | P2RX7 (0.49) | P2RX7HDAC6HDAC4HDAC1HDAC3 | |
| SCHEMBL5158596 | 0.75 | P2RX7 (0.49) | P2RX7HDAC6HDAC4HDAC1HDAC3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010059418-A1 | SUBSTITUTED TRIAZINE AND PURINE COMPOUNDS, METHODS OF INHIBITING CRUZAIN AND RHODESAIN AND METHODS OF TREATING CHAGAS DISEASE AND AFRICAN TRYPANOSOMIASIS | THE GOVERNMENT OF THE U.S.A. AS REPRESENTED BY THE SECRETARY OF THE DEPT. OF HEALTH & HUMAN SERVICES (US) | 2010-05-27 | — | — | WO | disclosed |
| WO-2010059418-A1 | SUBSTITUTED TRIAZINE AND PURINE COMPOUNDS, METHODS OF INHIBITING CRUZAIN AND RHODESAIN AND METHODS OF TREATING CHAGAS DISEASE AND AFRICAN TRYPANOSOMIASIS | THE GOVERNMENT OF THE U.S.A. AS REPRESENTED BY THE SECRETARY OF THE DEPT. OF HEALTH & HUMAN SERVICES (US) | 2010-05-27 | — | — | WO | disclosed |