Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 3/20 | 0.38 |
| ▸ | NOS3 | P29474 | 1/20 | 0.38 |
| ▸ | NOS1 | P29475 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL31514167 | 0.82 | EGFR (0.45) | NPSR1CYP2D6EGFRRAB9A | |
| SCHEMBL3064447 | 0.80 | POLB (0.47) | POLBHSD17B10CA12CA1CA2 | |
| SCHEMBL8469287 | 0.76 | CA12 (0.45) | POLBHSD17B10CA12CA1CA2 | |
| SCHEMBL7079371 | 0.76 | CA12 (0.45) | POLBHSD17B10CA12CA1CA2 | |
| SCHEMBL3081281 | 0.76 | CA12 (0.41) | POLBHSD17B10CA12CA1CA2 | |
| SCHEMBL3078061 | 0.76 | CA12 (0.41) | POLBHSD17B10CA12CA1CA2 | |
| SCHEMBL11728456 | 0.74 | HTT (0.39) | HSD17B10CA12CA1CA2CA9 | |
| SCHEMBL11722732 | 0.74 | ALDH1A1 (0.36) | HSD17B10CA2CA4CA5ANPSR1 | |
| SCHEMBL28467401 | 0.74 | MAPT (0.53) | HSD17B10CA12CA1CA2CA9 | |
| SCHEMBL14445184 | 0.72 | CA12 (0.38) | POLBHSD17B10CA12CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011095552-A1 | FLAME RETARDANT | BASF SE (DE) | 2011-08-11 | — | — | WO | disclosed |
| US-20110196052-A1 | FLAME RETARDANTS | BASF SE (DE) | 2011-08-11 | — | — | US | disclosed |
| US-20110196052-A1 | FLAME RETARDANTS | BASF SE (DE) | 2011-08-11 | — | — | US | disclosed |