Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 2/20 | 0.52 |
| ▸ | CTSB | P07858 | 1/20 | 0.52 |
| ▸ | CTSS | P25774 | 1/20 | 0.52 |
| ▸ | CTSK | P43235 | 1/20 | 0.52 |
| ▸ | OPRK1 | P41145 | 6/20 | 0.48 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.48 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.48 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.48 |
| ▸ | SLC6A9 | P48067 | 2/20 | 0.46 |
| ▸ | PLD1 | Q13393 | 6/20 | 0.45 |
| ▸ | PLD2 | O14939 | 4/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5799198 | 0.90 | OPRK1 (0.55) | CTSBCTSSCTSKOPRK1OPRM1 | |
| SCHEMBL5950765 | 0.84 | ENPP2 (0.50) | OPRK1OPRM1OPRD1OPRL1DRD3 | |
| SCHEMBL5802422 | 0.81 | NPC1L1 (0.49) | — | |
| SCHEMBL5802779 | 0.81 | OPRK1 (0.54) | CTSBCTSSCTSKOPRK1OPRM1 | |
| SCHEMBL5950420 | 0.81 | CCR5 (0.53) | CCR5CTSBCTSSCTSKOPRK1 | |
| SCHEMBL5800911 | 0.81 | NPC1L1 (0.49) | OPRK1OPRM1OPRD1OPRL1 | |
| SCHEMBL5800621 | 0.80 | CTSB (0.50) | CCR5CTSBCTSSCTSKOPRK1 | |
| SCHEMBL6632646 | 0.79 | PLD2 (0.46) | CTSBCTSSCTSKOPRK1OPRM1 | |
| SCHEMBL318858 | 0.79 | CCR5 (0.75) | CCR5OPRK1OPRM1OPRD1OPRL1 | |
| SCHEMBL4981531 | 0.77 | SLC6A9 (0.57) | CCR5CTSBCTSSCTSKOPRK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1329451-B1 | SPIRO COMPOUNDS AND ADHESION MOLECULE INHIBITORS CONTAINING THE SAME AS THE ACTIVE INGREDIENT | TORAY INDUSTRIES (JP) | 2006-08-23 | — | — | EP | disclosed |
| EP-1489081-A1 | SPIRO DERIVATIVES AND ADHESION MOLECULE INHIBITORS COMPRISING THE SAME AS THE ACTIVE INGREDIENT | TORAY INDUSTRIES, INC. (JP) | 2004-12-22 | — | — | EP | disclosed |
| EP-1329451-A1 | SPIRO COMPOUNDS AND ADHESION MOLECULE INHIBITORS CONTAINING THE SAME AS THE ACTIVE INGREDIENT | TORAY INDUSTRIES, INC. (JP) | 2003-07-23 | — | — | EP | disclosed |