Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.32 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | GFER | P55789 | 1/20 | 0.31 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | TOP2A | P11388 | 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 | |
|---|---|---|---|---|
| SCHEMBL7038794 | 0.92 | HSD11B1 (0.40) | S1PR1NISCHHSD11B1MAPTNPC1 | |
| SCHEMBL7034694 | 0.90 | HSD11B1 (0.40) | HSD11B1MAPTRAB9AMEN1ALDH1A1 | |
| SCHEMBL7037129 | 0.89 | EDNRB (0.35) | MAPTNPC1RAB9AALDH1A1 | |
| SCHEMBL7036307 | 0.87 | S1PR1 (0.32) | S1PR1NISCHMAPTNPC1RAB9A | |
| SCHEMBL7036446 | 0.86 | S1PR1 (0.32) | S1PR1NISCHHSD11B1MAPTNPC1 | |
| SCHEMBL7037024 | 0.84 | HSD11B1 (0.34) | S1PR1NISCHHSD11B1MAPTNPC1 | |
| SCHEMBL7037419 | 0.84 | S1PR1 (0.31) | S1PR1 | |
| SCHEMBL26606293 | 0.83 | — | — | |
| SCHEMBL1454590 | 0.83 | ADORA3 (0.33) | MAPTNPC1RAB9AMEN1ALDH1A1 | |
| SCHEMBL20892233 | 0.83 | BRD4 (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6620953-B1 | Complexing dimethylbis(2-methyl-4,5-benzoindenyl)silane with transition metal compounds such as 2,4-di-tert-butylphenoxide, zirconium monochloride, to form polymerization catalysts | BASSELL POLYOLEFINE GMBH (DE) | 2003-09-16 | — | — | US | disclosed |
| EP-1133504-B1 | METHOD FOR PRODUCING MONOARYLOXY-ANSA-METALLOCENES | BASELL POLYOLEFINE GMBH (DE) | 2003-03-12 | — | — | EP | disclosed |