Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACVR1 | Q04771 | 1/20 | 0.32 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.31 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.31 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.31 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.31 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.31 |
| ▸ | WDR5 | P61964 | 1/20 | 0.30 |
| ▸ | HTR1D | P28221 | 2/20 | 0.30 |
| ▸ | HTR1B | P28222 | 2/20 | 0.30 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.30 |
| ▸ | ALK | Q9UM73 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4719251 | 0.93 | ACVR1 (0.35) | ACVR1AKR1B10AKR1C4AKR1C3AKR1C2 | |
| SCHEMBL4719467 | 0.87 | WDR5 (0.34) | ACVR1WDR5 | |
| SCHEMBL4721097 | 0.87 | PLK1 (0.30) | — | |
| SCHEMBL4722741 | 0.87 | UCHL1 (0.38) | AKR1C4AKR1C3AKR1C2AKR1C1CXCR3 | |
| SCHEMBL4722534 | 0.87 | ACVR1 (0.34) | ACVR1AKR1B10AKR1C4AKR1C3AKR1C2 | |
| SCHEMBL14101950 | 0.86 | UCHL1 (0.37) | ACVR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL4719537 | 0.81 | S1PR1 (0.35) | AKR1C4AKR1C3AKR1C2AKR1C1CXCR3 | |
| SCHEMBL4722418 | 0.80 | PDCD1 (0.32) | — | |
| SCHEMBL4722284 | 0.80 | LIPG (0.38) | — | |
| SCHEMBL4722281 | 0.80 | LIPG (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1953147-A1 | HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF | Japan Tobacco, Inc. (JP) | 2008-08-06 | — | — | EP | disclosed |
| EP-1953147-A1 | HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF | Japan Tobacco, Inc. (JP) | 2008-08-06 | — | — | EP | disclosed |