Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 3/20 | 0.41 |
| ▸ | CCR5 | P51681 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | CCR8 | P51685 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10032292 | 0.94 | RAB9A (0.39) | CCR1CCR5RAB9AADORA2AADORA1 | |
| SCHEMBL10032328 | 0.92 | KMO (0.40) | RAB9AADORA2AADORA1NPC1MAP4K4 | |
| SCHEMBL10032284 | 0.88 | PARP1 (0.45) | RAB9AADORA2AADORA1CYP1A2NPC1 | |
| SCHEMBL10032480 | 0.85 | SMN1; SMN2 (0.44) | CCR1CCR5RAB9ANPC1 | |
| SCHEMBL30112629 | 0.84 | CCR1 (0.56) | CCR1CCR5CCR8CYP1A2 | |
| SCHEMBL10032335 | 0.84 | AR (0.40) | CCR1CCR5ADORA2AADORA1CCR8 | |
| SCHEMBL10032538 | 0.83 | CCR1 (0.65) | CCR1CCR5RAB9ACYP1A2CYP2A6 | |
| SCHEMBL11962231 | 0.82 | CNR2 (0.35) | CCR1CCR5RAB9ANPC1 | |
| SCHEMBL25776067 | 0.81 | MAOA (0.43) | ADORA2AADORA1CYP1A2CYP2A6 | |
| SCHEMBL14420889 | 0.80 | NOTUM (0.42) | CYP1A2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8114529-B2 | Material for lighting emitting device and light emitting device | TORAY INDUSTRIES, INC. (JP) | 2012-02-14 | — | — | US | disclosed |
| US-8114529-B2 | Material for lighting emitting device and light emitting device | TORAY INDUSTRIES, INC. (JP) | 2012-02-14 | — | — | US | disclosed |
| US-20070267958-A1 | Material for Light Emitting Device and Light Emitting Device | TORAY INDUSTRIES, INC. (JP) | 2007-11-22 | — | — | US | disclosed |
| US-20070267958-A1 | Material for Light Emitting Device and Light Emitting Device | TORAY INDUSTRIES, INC. (JP) | 2007-11-22 | — | — | US | disclosed |