Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 14/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 9/20 | 0.44 |
| ▸ | AR | P10275 | 4/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28860946 | 0.90 | ESR1 (0.47) | ESR1ESR2ARTP53TDP1 | |
| SCHEMBL6260738 | 0.89 | ESR1 (0.48) | ESR1ESR2ARTP53TDP1 | |
| SCHEMBL19425427 | 0.85 | TDP1 (0.50) | ESR1ESR2TDP1ALDH1A1HPGD | |
| SCHEMBL28081438 | 0.85 | ESR1 (0.41) | ESR1ESR2ARTP53TDP1 | |
| SCHEMBL3873634 | 0.82 | GAA (0.47) | ESR1ESR2ARTDP1ALDH1A1 | |
| SCHEMBL339131 | 0.81 | ESR1 (0.44) | ESR1ESR2ARTDP1USP2 | |
| SCHEMBL68663 | 0.81 | ESR1 (0.47) | ESR1ESR2ARTP53TDP1 | |
| SCHEMBL12165869 | 0.81 | ESR1 (0.38) | ESR1ESR2ARTP53TDP1 | |
| SCHEMBL3237146 | 0.81 | ESR1 (0.71) | ESR1ESR2ARALDH1A1 | |
| SCHEMBL27982153 | 0.81 | ESR1 (0.42) | ESR1ESR2ARTP53TDP1 |
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-2010123006-A1 | PYRROLIDINE COMPOUND | 武田薬品工業株式会社 (JP) | 2010-10-28 | — | — | WO | disclosed |