Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 2/20 | 0.37 |
| ▸ | THRB | P10828 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TYR | P14679 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.33 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.33 |
| ▸ | TACR2 | P21452 | 2/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL5572576 | 0.93 | PTGS2 (0.37) | TP53CYP3A4MEN1ALOX5MAPT | |
| SCHEMBL14666230 | 0.93 | PTGS2 (0.37) | TP53CYP3A4MEN1ALOX5MAPT | |
| SCHEMBL13197214 | 0.93 | PTGS2 (0.37) | TP53CYP3A4MEN1ALOX5MAPT | |
| SCHEMBL4789204 | 0.87 | TLR8 (0.33) | TP53CYP3A4MEN1ALOX5MAPT | |
| SCHEMBL12610457 | 0.86 | GPR35 (0.33) | TP53CYP3A4MEN1ALOX5MAPT | |
| SCHEMBL15478097 | 0.86 | GPR35 (0.33) | TP53CYP3A4MEN1ALOX5MAPT | |
| SCHEMBL14667889 | 0.86 | GPR35 (0.33) | TP53CYP3A4MEN1ALOX5MAPT | |
| SCHEMBL96286 | 0.81 | PTGS2 (0.36) | TP53CYP3A4MAPTPTGS2ESR1 | |
| SCHEMBL86120 | 0.81 | GPR35 (0.31) | GPR35 | |
| SCHEMBL13839137 | 0.80 | GPR35 (0.31) | GPR35 |
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 |
|---|---|---|---|---|---|---|---|
| US-8847068-B2 | Compositions, methods, and systems comprising poly(thiophenes) | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2014-09-30 | — | — | US | disclosed |
| WO-2012044778-A1 | COMPOSITIONS, METHODS, AND SYSTEMS COMPRISING POLY(THIOPHENES) | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2012-04-05 | — | — | WO | disclosed |
| US-20120073662-A1 | COMPOSITIONS, METHODS, AND SYSTEMS COMPRISING POLY(THIOPHENES) | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2012-03-29 | — | — | US | disclosed |