Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.43 |
| ▸ | DPP4 | P27487 | 5/20 | 0.42 |
| ▸ | ARG1 | P05089 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL17715154 | 1.00 | NR1H2 (0.43) | NR1H2DPP4ARG1MAPK1 | |
| SCHEMBL29308168 | 1.00 | NR1H2 (0.43) | NR1H2DPP4ARG1MAPK1 | |
| SCHEMBL17715141 | 1.00 | NR1H2 (0.43) | NR1H2DPP4ARG1MAPK1 | |
| SCHEMBL27418796 | 0.87 | DPP4 (0.44) | NR1H2DPP4ARG1 | |
| SCHEMBL16797265 | 0.85 | ARG1 (0.34) | NR1H2DPP4ARG1 | |
| SCHEMBL27600115 | 0.85 | ARG1 (0.34) | NR1H2DPP4ARG1 | |
| SCHEMBL27682940 | 0.84 | NR1H2 (0.41) | NR1H2DPP4ARG1 | |
| SCHEMBL27671561 | 0.83 | DPP4 (0.33) | NR1H2DPP4ARG1 | |
| SCHEMBL14979644 | 0.82 | DPP4 (0.42) | DPP4ARG1 | |
| SCHEMBL5500605 | 0.82 | DPP4 (0.42) | DPP4ARG1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2456436-A1 | 3-PHENOXYMETHYLPYRROLIDINE COMPOUNDS | Theravance, Inc. (US) | 2012-05-30 | — | — | EP | disclosed |
| WO-2011011231-A1 | 3-PHENOXYMETHYLPYRROLIDINE COMPOUNDS | THERAVANCE, INC. (US) | 2011-01-27 | — | — | WO | disclosed |
| CN-100439344-C | 4-Anilinoquinazoline derivatives as antiproliferative agents | ASTRAZENECA AB (SE) | 2008-12-03 | — | — | CN | disclosed |
| CN-101003515-A | 4-anilino quinazoline derivatives as antiproliferative agents | ASTRAZENECA AB (SE) | 2007-07-25 | — | — | CN | disclosed |
| CN-1656081-A | 4-Anilinoquinazoline derivatives as antiproliferative agents | ASTRAZENECA AB (SE) | 2005-08-17 | — | — | CN | disclosed |