Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | AHCY | P23526 | 1/20 | 0.35 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.33 |
| ▸ | TACR3 | P29371 | 2/20 | 0.33 |
| ▸ | HTR2C | P28335 | 3/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.32 |
| ▸ | STS | P08842 | 1/20 | 0.32 |
| ▸ | CCR5 | P51681 | 1/20 | 0.32 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.31 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.31 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13721085 | 1.00 | CPB2 (0.38) | CPB2SMN1; SMN2TDP1SLC6A4SLC6A3 | |
| SCHEMBL4021855 | 0.86 | TACR3 (0.39) | SMN1; SMN2TDP1SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL4022865 | 0.86 | TACR3 (0.39) | SMN1; SMN2TDP1SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL4024991 | 0.80 | L3MBTL1 (0.41) | CPB2SLC6A4RIPK1TACR3HTR2C | |
| SCHEMBL6172602 | 0.80 | CCR2 (0.36) | SMN1; SMN2TDP1SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL13720388 | 0.74 | SLC6A4 (0.36) | SLC6A4SLC6A3SLC6A2HTR2CUSP30 | |
| SCHEMBL13720136 | 0.74 | SLC6A4 (0.36) | SLC6A4SLC6A3SLC6A2HTR2CUSP30 | |
| SCHEMBL13720416 | 0.74 | SLC6A4 (0.36) | SLC6A4SLC6A3SLC6A2HTR2CUSP30 | |
| SCHEMBL4681356 | 0.74 | SLC6A4 (0.36) | SLC6A4SLC6A3SLC6A2HTR2CUSP30 | |
| SCHEMBL13720163 | 0.74 | SLC6A4 (0.36) | SLC6A4SLC6A3SLC6A2HTR2CUSP30 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7569579-B2 | for inhibition of HIV replication and treatment of acquired immune deficiency syndrome | SMITHKLINE BEECHAM CORPORATION (US) | 2009-08-04 | — | — | US | disclosed |
| US-7569579-B2 | for inhibition of HIV replication and treatment of acquired immune deficiency syndrome | SMITHKLINE BEECHAM CORPORATION (US) | 2009-08-04 | — | — | US | disclosed |
| EP-1569934-B1 | CYCLOPROPYL COMPOUNDS AS CCR5 ANTAGONISTS | SMITHKLINE BEECHAM CORP (US) | 2008-01-23 | — | — | EP | disclosed |