Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | CTSS | P25774 | 1/20 | 0.41 |
| ▸ | PPARA | Q07869 | 2/20 | 0.41 |
| ▸ | SYK | P43405 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.40 |
| ▸ | NPFFR1 | Q9GZQ6 | 1/20 | 0.38 |
| ▸ | NPFFR2 | Q9Y5X5 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | KLK7 | P49862 | 3/20 | 0.38 |
| ▸ | KLK5 | Q9Y337 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | NAMPT | P43490 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13720294 | 1.00 | IDO1 (0.43) | IDO1CTSSPPARASYKSIGMAR1 | |
| SCHEMBL13720464 | 0.89 | SYK (0.45) | IDO1CTSSPPARASYKSIGMAR1 | |
| SCHEMBL13720411 | 0.89 | SYK (0.45) | IDO1CTSSPPARASYKSIGMAR1 | |
| SCHEMBL13720143 | 0.89 | SYK (0.45) | IDO1CTSSPPARASYKSIGMAR1 | |
| SCHEMBL13720351 | 0.85 | IDO1 (0.42) | IDO1SIGMAR1NPFFR1NPFFR2BCHE | |
| SCHEMBL6173847 | 0.84 | LMNA (0.42) | IDO1MAPTLMNASMN1; SMN2KMT2A | |
| SCHEMBL13720265 | 0.79 | IDO1 (0.41) | IDO1SIGMAR1NPFFR1NPFFR2BCHE | |
| SCHEMBL13720690 | 0.79 | IDO1 (0.41) | IDO1SIGMAR1NPFFR1NPFFR2BCHE | |
| SCHEMBL4028380 | 0.79 | L3MBTL1 (0.43) | CTSSPPARAL3MBTL1 | |
| SCHEMBL4029654 | 0.79 | L3MBTL1 (0.43) | CTSSPPARAL3MBTL1 |
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 |