Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 6/20 | 0.32 |
| ▸ | S1PR5 | Q9H228 | 5/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.31 |
| ▸ | NOS3 | P29474 | 1/20 | 0.30 |
| ▸ | NOS1 | P29475 | 1/20 | 0.30 |
| ▸ | NOS2 | P35228 | 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 | |
|---|---|---|---|---|
| SCHEMBL3403875 | 0.93 | S1PR1 (0.32) | S1PR1S1PR5CYP3A4CYP2C9S1PR3 | |
| SCHEMBL3075175 | 0.86 | S1PR1 (0.33) | S1PR1S1PR5CYP3A4CYP2C9S1PR3 | |
| SCHEMBL3398829 | 0.86 | — | — | |
| SCHEMBL3401166 | 0.85 | — | — | |
| Hydrochloric Acid SCHEMBL3402751 | 0.83 | S1PR1 (0.32) | S1PR1S1PR5CYP3A4CYP2C9S1PR3 | |
| Hydrochloric Acid SCHEMBL3403883 | 0.83 | S1PR1 (0.32) | S1PR1S1PR5CYP3A4CYP2C9S1PR3 | |
| SCHEMBL3403027 | 0.83 | S1PR1 (0.34) | S1PR1S1PR5 | |
| SCHEMBL3397404 | 0.82 | — | — | |
| SCHEMBL3400361 | 0.82 | — | — | |
| SCHEMBL3402719 | 0.82 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2235071-A2 | METALLOCENE COMPOUNDS, CATALYSTS COMPRISING THEM, PROCESS FOR PRODUCING AN OLEFIN POLYMER BY USE OF THE CATALYSTS, AND OLEFIN HOMO AND COPOLYMERS | Novolen Technology Holdings, C.V. (NL) | 2010-10-06 | — | — | EP | claimed |
| WO-2009054833-A2 | METALLOCENE COMPOUNDS, CATALYSTS COMPRISING THEM, PROCESS FOR PRODUCING AN OLEFIN POLYMER BY USE OF THE CATALYSTS, AND OLEFIN HOMO AND COPOLYMERS | NOVOLEN TECHNOLOGY HOLDINGS, C.V. (NL) | 2009-04-30 | — | — | WO | claimed |
| EP-2235071-A2 | METALLOCENE COMPOUNDS, CATALYSTS COMPRISING THEM, PROCESS FOR PRODUCING AN OLEFIN POLYMER BY USE OF THE CATALYSTS, AND OLEFIN HOMO AND COPOLYMERS | Novolen Technology Holdings, C.V. (NL) | 2010-10-06 | — | — | EP | disclosed |
| WO-2009054833-A2 | METALLOCENE COMPOUNDS, CATALYSTS COMPRISING THEM, PROCESS FOR PRODUCING AN OLEFIN POLYMER BY USE OF THE CATALYSTS, AND OLEFIN HOMO AND COPOLYMERS | NOVOLEN TECHNOLOGY HOLDINGS, C.V. (NL) | 2009-04-30 | — | — | WO | disclosed |