Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CREBBP | Q92793 | 1/20 | 0.32 |
| ▸ | IMPDH2 | P12268 | 2/20 | 0.31 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | RHOA | P61586 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.30 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.30 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.30 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.30 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.30 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.30 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.30 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.30 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14101802 | 0.93 | — | — | |
| SCHEMBL4723886 | 0.92 | P2RY1 (0.33) | CREBBPIMPDH2P2RY1ACHERHOA | |
| SCHEMBL4723382 | 0.91 | ACHE (0.34) | CREBBPP2RY1ACHE | |
| SCHEMBL4719544 | 0.91 | CNR1 (0.33) | CREBBP | |
| SCHEMBL4765691 | 0.90 | CREBBP (0.32) | CREBBPIMPDH2 | |
| SCHEMBL4719705 | 0.88 | BACE1 (0.33) | CREBBPIMPDH2P2RY1RHOA | |
| SCHEMBL4723733 | 0.88 | BACE1 (0.31) | CREBBP | |
| SCHEMBL4722202 | 0.87 | CREBBP (0.36) | CREBBPIMPDH2P2RY1RHOALIMK2 | |
| SCHEMBL4721258 | 0.83 | BACE1 (0.30) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL4720247 | 0.79 | BACE1 (0.32) | IMPDH2P2RY1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1953147-A1 | HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF | Japan Tobacco, Inc. (JP) | 2008-08-06 | — | — | EP | disclosed |