Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 1/20 | 0.48 |
| ▸ | HCRTR1 | O43613 | 12/20 | 0.47 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.46 |
| ▸ | TUBB | P07437 | 1/20 | 0.46 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.46 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.46 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.46 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.46 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.46 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.46 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.46 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.46 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.46 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.46 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.46 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.46 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.46 |
| ▸ | HCRTR2 | O43614 | 8/20 | 0.45 |
| ▸ | BRD4 | O60885 | 1/20 | 0.44 |
| ▸ | BRD2 | P25440 | 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 | |
|---|---|---|---|---|
| SCHEMBL9955206 | 0.89 | KDM4E (0.47) | BTKHCRTR1BRD4BRD2BRD3 | |
| SCHEMBL29814525 | 0.89 | KDM4E (0.47) | BTKHCRTR1BRD4BRD2BRD3 | |
| SCHEMBL19499711 | 0.89 | BRD4 (0.50) | BTKHCRTR1TUBB4ATUBBTUBA3C | |
| SCHEMBL9955328 | 0.85 | CYP46A1 (0.63) | BTKHCRTR1TUBB4ATUBBTUBA3C | |
| SCHEMBL27870875 | 0.81 | HCRTR1 (0.54) | HCRTR1TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL5330963 | 0.80 | NPC1 (0.49) | BTKBRD4BRD2BRD3BAZ2B | |
| SCHEMBL22468515 | 0.79 | KDM4E (0.47) | BTKBRD4BRD2BRD3BAZ2B | |
| SCHEMBL27870880 | 0.79 | CYP46A1 (0.46) | HCRTR1HCRTR2KDM4ENPC1RAB9A | |
| SCHEMBL3423163 | 0.79 | KDM4E (0.50) | BTKKDM4ENPC1ALDH1A1TP53 | |
| SCHEMBL9202323 | 0.79 | KDM4E (0.50) | HCRTR1HCRTR2BRD4BRD2BRD3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102471314-A | Spiro amino compounds suitable for the treatment of inter alia sleep disorders and drug addiction | ROTTAPHARM SPA | 2012-05-23 | — | — | CN | disclosed |