Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 1/20 | 0.52 |
| ▸ | CTSK | P43235 | 1/20 | 0.52 |
| ▸ | CHRND | Q07001 | 6/20 | 0.48 |
| ▸ | CHRNA1 | P02708 | 2/20 | 0.48 |
| ▸ | CHRNG | P07510 | 2/20 | 0.48 |
| ▸ | CHRNB1 | P11230 | 2/20 | 0.48 |
| ▸ | OPRD1 | P41143 | 4/20 | 0.48 |
| ▸ | CCKBR | P32239 | 3/20 | 0.48 |
| ▸ | CCKAR | P32238 | 3/20 | 0.48 |
| ▸ | GRIA1 | P42261 | 4/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9317466 | 1.00 | CTSS (0.52) | CTSSCTSKCHRNDCHRNA1CHRNG | |
| SCHEMBL30645671 | 0.90 | CTSS (0.61) | CTSSCTSKGRIA1 | |
| SCHEMBL31181957 | 0.90 | CTSS (0.61) | CTSSCTSKGRIA1 | |
| SCHEMBL30645691 | 0.87 | CTSS (0.62) | CTSSCTSKGRIA1 | |
| SCHEMBL30772338 | 0.86 | CTSS (0.58) | CTSSCTSK | |
| SCHEMBL31383409 | 0.86 | CTSS (0.58) | CTSSCTSK | |
| SCHEMBL31490594 | 0.86 | PAX8 (0.51) | CTSSCTSKOPRD1CCKBRCCKAR | |
| SCHEMBL29630584 | 0.85 | CHRND (0.53) | CHRNDCHRNA1CHRNGCHRNB1GRIA1 | |
| SCHEMBL29472199 | 0.85 | F2 (0.48) | CTSSCTSKOPRD1CCKBRCCKAR | |
| SCHEMBL31019379 | 0.85 | CTSS (0.59) | CTSSCTSK |
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 |
|---|---|---|---|---|---|---|---|
| US-H1312-H | Method for the preparation of gyk-dtpa | CYTOGEN CORPORATION (US) | 1994-05-03 | — | — | US | disclosed |