Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.45 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.45 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.44 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.44 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | PIP4K2A | P48426 | 1/20 | 0.40 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.40 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.40 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.40 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.40 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2104023 | 0.82 | KDM4E (0.51) | KDM4EMTNR1AMTNR1BPTGS1PTGS2 | |
| SCHEMBL2104022 | 0.82 | KDM4E (0.51) | KDM4EMTNR1AMTNR1BPTGS1PTGS2 | |
| SCHEMBL4820296 | 0.81 | TRPA1 (0.56) | KDM4EPIP4K2AGRIN2DGRIN3BGRIN1 | |
| SCHEMBL29981581 | 0.81 | TRPA1 (0.56) | KDM4EPIP4K2AGRIN2DGRIN3BGRIN1 | |
| Dimethylamine SCHEMBL6748737 | 0.79 | KMT2A (0.53) | KDM4EMTNR1AMTNR1BPIP4K2AALDH1A1 | |
| SCHEMBL6027912 | 0.79 | KDM4E (0.54) | KDM4EMTNR1AMTNR1BPTGS1PTGS2 | |
| SCHEMBL28257775 | 0.77 | KDM4E (0.57) | KDM4EMTNR1AMTNR1BPTGS1PTGS2 | |
| SCHEMBL9735153 | 0.76 | ALDH1A1 (0.50) | KDM4EPIP4K2AALDH1A1MAPTMAPK1 | |
| SCHEMBL9735148 | 0.76 | ALDH1A1 (0.50) | KDM4EPIP4K2AALDH1A1MAPTMAPK1 | |
| SCHEMBL29164994 | 0.76 | PIP4K2A (0.53) | KDM4EPIP4K2AGRIN2DGRIN3BGRIN1 |
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-7476752-B2 | Processes for the preparation of 2-cyano-3-naphthalene-1-yl-3-phenyl-propionic acid alkyl or benzyl esters | WYETH (US) | 2009-01-13 | — | — | US | disclosed |