Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 4/20 | 0.43 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.43 |
| ▸ | ABAT | P80404 | 2/20 | 0.42 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | IDO1 | P14902 | 2/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HTR3A | P46098 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | FNTA | P49354 | 1/20 | 0.39 |
| ▸ | FNTB | P49356 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL105690 | 0.82 | ESR1 (0.52) | ESR1ESR2CA2CAMK2AABAT | |
| SCHEMBL16414794 | 0.77 | KDM4E (0.48) | ESR1ESR2CA2CAMK2AABAT | |
| SCHEMBL6786353 | 0.77 | KDM4E (0.48) | ESR1ESR2CA2CAMK2AABAT | |
| SCHEMBL7069220 | 0.75 | MAOB (0.55) | CA2ALDH1A1IDO1TAAR1KMT2A | |
| SCHEMBL448422 | 0.74 | ESR1 (0.55) | ESR1ESR2CA2CAMK2AABAT | |
| SCHEMBL448421 | 0.74 | ESR1 (0.55) | ESR1ESR2CA2CAMK2AABAT | |
| Succinic Acid SCHEMBL729634 | 0.73 | CA2 (0.56) | ESR1ESR2CA2CAMK2AALDH1A1 | |
| Hydroquinone SCHEMBL28950382 | 0.73 | MAPT (0.61) | ESR1ESR2CA2ABATALDH5A1 | |
| SCHEMBL3805915 | 0.72 | ESR1 (0.52) | ESR1ESR2CA2CAMK2AABAT | |
| SCHEMBL27814917 | 0.72 | ESR1 (0.52) | ESR1ESR2CA2CAMK2AABAT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007038571-A2 | PROLYL HYDROXYLASE ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 2007-04-05 | — | — | WO | disclosed |