Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.54 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.54 |
| ▸ | PDE4A | P27815 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | GAA | P10253 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | APEX1 | P27695 | 1/20 | 0.51 |
| ▸ | ABCC2 | Q92887 | 1/20 | 0.50 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | PPM1B | O75688 | 1/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.46 |
| ▸ | PARP1 | P09874 | 1/20 | 0.45 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL21092645 | 1.00 | ESR1 (0.54) | ESR1PTGS1PDE4AALDH1A1GAA | |
| SCHEMBL22251574 | 1.00 | ESR1 (0.54) | ESR1PTGS1PDE4AALDH1A1GAA | |
| SCHEMBL18710626 | 1.00 | ESR1 (0.54) | ESR1PTGS1PDE4AALDH1A1GAA | |
| SCHEMBL25111554 | 0.85 | DPP4 (0.54) | ALDH1A1GAAL3MBTL1HPGDMEN1 | |
| SCHEMBL881405 | 0.85 | GAA (0.52) | ESR1PTGS1PDE4AALDH1A1GAA | |
| SCHEMBL6929089 | 0.85 | GAA (0.52) | ESR1PTGS1PDE4AALDH1A1GAA | |
| SCHEMBL22251644 | 0.84 | ESR1 (0.54) | ESR1PTGS1PDE4AALDH1A1GAA | |
| SCHEMBL18155184 | 0.84 | ESR1 (0.54) | ESR1PTGS1PDE4AALDH1A1GAA | |
| SCHEMBL24093821 | 0.84 | ESR1 (0.49) | ESR1PTGS1PDE4AALDH1A1GAA | |
| SCHEMBL14769640 | 0.84 | ESR1 (0.54) | ESR1PTGS1PDE4AALDH1A1GAA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9469861-B2 | Cell-free preparation of carbapenems | GREENLIGHT BIOSCIENCES, INC. (US) | 2016-10-18 | — | — | US | disclosed |