Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | PARP1 | P09874 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
| ▸ | CNR2 | P34972 | 1/20 | 0.30 |
| ▸ | TYK2 | P29597 | 2/20 | 0.30 |
| ▸ | LIPE | Q05469 | 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 | |
|---|---|---|---|---|
| SCHEMBL4695599 | 0.73 | KDM4E (0.38) | TDP1EGLN1LMNAPARP1CNR2 | |
| SCHEMBL12378256 | 0.69 | PARP1 (0.33) | PARP1 | |
| SCHEMBL12378318 | 0.69 | PARP1 (0.32) | PARP1 | |
| SCHEMBL12378375 | 0.69 | KDM5A (0.34) | PARP1CNR1CNR2 | |
| SCHEMBL12415956 | 0.66 | PARP1 (0.30) | PARP1 | |
| SCHEMBL12418392 | 0.65 | CSF1R (0.35) | PARP1CNR2TYK2 | |
| SCHEMBL12378262 | 0.65 | GRM2 (0.35) | TDP1PARP1CNR1CNR2 | |
| SCHEMBL14384961 | 0.65 | GRM2 (0.34) | PARP1CNR2TYK2 | |
| SCHEMBL12378656 | 0.65 | COMT (0.30) | — | |
| SCHEMBL14265290 | 0.63 | — | — |
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-1888581-A2 | HIV-INTEGRASE INHIBITOR COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2008-02-20 | — | — | EP | disclosed |
| WO-2006125048-A2 | HIV-INTEGRASE INHIBITOR COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2006-11-23 | — | — | WO | disclosed |