Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.39 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | PTP4A3 | O75365 | 1/20 | 0.33 |
| ▸ | PTP4A1 | Q93096 | 1/20 | 0.33 |
| ▸ | SNCA | P37840 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL669729 | 0.97 | — | — | |
| SCHEMBL3458279 | 0.95 | CYP3A4 (0.42) | CYP3A4MAPTTSHRCACNA1BAPBA1 | |
| Hydrochloric Acid SCHEMBL9595329 | 0.95 | CYP3A4 (0.42) | CYP3A4MAPTTSHRCACNA1BAPBA1 | |
| SCHEMBL177943 | 0.84 | CYP3A4 (0.48) | CYP3A4MAPTTSHRCACNA1BAPBA1 | |
| SCHEMBL10497073 | 0.83 | CYP3A4 (0.35) | CYP3A4MAPTTSHRCACNA1BAPBA1 | |
| SCHEMBL7512684 | 0.81 | CYP3A4 (0.46) | CYP3A4MAPTTSHRCACNA1BAPBA1 | |
| SCHEMBL11277855 | 0.81 | CYP3A4 (0.39) | CYP3A4MAPTTSHRCACNA1BAPBA1 | |
| SCHEMBL11278938 | 0.81 | CYP3A4 (0.39) | CYP3A4MAPTTSHRCACNA1BAPBA1 | |
| SCHEMBL2733016 | 0.81 | CYP3A4 (0.39) | CYP3A4MAPTTSHRCACNA1BAPBA1 | |
| SCHEMBL44692 | 0.80 | — | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1805243-B1 | POLYTRIMETHYLENE TEREPHTHALATE HAVING A LOW LEVEL OF ACROLEIN AND A PROCESS FOR PRODUCING THE SAME | LURGI ZIMMER GMBH (DE) | 2013-01-09 | — | — | EP | disclosed |
| US-20120141723-A1 | POLYMER FIBER CONTAINING FLAME RETARDANT, PROCESS FOR PRODUCING THE SAME, AND MATERIAL CONTAINING SUCH FIBERS | SHELL OIL COMPANY | 2012-06-07 | — | — | US | disclosed |
| EP-2084170-A1 | POLYMER FIBER CONTAINING FLAME RETARDANT, PROCESS FOR PRODUCING THE SAME, AND MATERIAL CONTAINING SUCH FIBERS | Shell Internationale Research Maatschappij B.V. (NL) | 2009-08-05 | — | — | EP | disclosed |
| EP-2084169-A1 | POLYMER COMPOSITION CONTAINING FLAME RETARDANT AND PROCESS FOR PRODUCING THE SAME | Shell Internationale Research Maatschappij B.V. (NL) | 2009-08-05 | — | — | EP | disclosed |
| US-20080194793-A1 | POLYTRIMETHYLENE TEREPHTHALATE HAVING A LOW LEVEL OF ACROLEIN AND A PROCESS FOR PRODUCING THE SAME | KELSEY DONALD ROSS | 2008-08-14 | — | — | US | disclosed |
| US-20080132620-A1 | POLYMER COMPOSITION CONTAINING FLAME RETARDANT AND PROCESS FOR PRODUCING THE SAME | SHELL OIL COMPANY | 2008-06-05 | — | — | US | disclosed |
| US-7381787-B2 | Polytrimethylene terephthalate having a low level of acrolein and a process for producing the same | SHELL OIL COMPANY (US) | 2008-06-03 | — | — | US | disclosed |
| WO-2008061075-A1 | POLYMER COMPOSITION CONTAINING FLAME RETARDANT AND PROCESS FOR PRODUCING THE SAME | SHELL OIL COMPANY (US) | 2008-05-22 | — | — | WO | disclosed |
| WO-2008061087-A1 | POLYMER FIBER CONTAINING FLAME RETARDANT, PROCESS FOR PRODUCING THE SAME, AND MATERIAL CONTAINING SUCH FIBERS | SHELL OIL COMPANY (US) | 2008-05-22 | — | — | WO | disclosed |
| EP-1805243-A1 | POLYTRIMETHYLENE TEREPHTHALATE HAVING A LOW LEVEL OF ACROLEIN AND A PROCESS FOR PRODUCING THE SAME | SHELL INTERNATIONAL RESEARCH MAATSCHAPPIJ B.V. (NL) | 2007-07-11 | — | — | EP | disclosed |
| US-20060084783-A1 | Polytrimethylene terephthalate having a low level of acrolein and a process for producing the same | LURGI ZIMMER GMBH (DE) | 2006-04-20 | — | — | US | disclosed |
| WO-2006033917-A1 | POLYTRIMETHYLENE TEREPHTHALATE HAVING A LOW LEVEL OF ACROLEIN AND A PROCESS FOR PRODUCING THE SAME | SHELL INTERNATIONAL RESEARCH MAATSCHAPPIJ B.V. (NL) | 2006-03-30 | — | — | WO | disclosed |