Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.60 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.60 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.54 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | SRD5A2 | P31213 | 4/20 | 0.53 |
| ▸ | RXRA | P19793 | 3/20 | 0.53 |
| ▸ | RXRB | P28702 | 3/20 | 0.53 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.53 |
| ▸ | RARB | P10826 | 1/20 | 0.49 |
| ▸ | RARG | P13631 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | RXRG | P48443 | 2/20 | 0.46 |
| ▸ | MMP8 | P22894 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL22522161 | 0.95 | SRD5A2 (0.62) | ESR1ESR2EPHX2NR1H4ALDH1A1 | |
| SCHEMBL29144959 | 0.93 | ESR1 (0.52) | ESR1ESR2EPHX2NR1H4ALDH1A1 | |
| SCHEMBL4679096 | 0.82 | THRB (0.61) | ESR1EPHX2NR1H4ALDH1A1SRD5A2 | |
| SCHEMBL12491968 | 0.80 | ALDH1A1 (0.57) | EPHX2NR1H4ALDH1A1SRD5A2RXRA | |
| SCHEMBL1598468 | 0.80 | ALDH1A1 (0.52) | EPHX2NR1H4ALDH1A1SRD5A2RXRA | |
| SCHEMBL9653084 | 0.80 | SRD5A2 (0.57) | EPHX2NR1H4ALDH1A1SRD5A2RXRA | |
| SCHEMBL444583 | 0.80 | MEN1 (0.59) | EPHX2NR1H4ALDH1A1SRD5A2RXRA | |
| SCHEMBL23085456 | 0.79 | ESR1 (0.53) | ESR1ESR2EPHX2NR1H4KMT2A | |
| SCHEMBL2804705 | 0.78 | SRD5A2 (0.55) | EPHX2NR1H4ALDH1A1SRD5A2RXRA | |
| SCHEMBL448814 | 0.78 | SHBG (0.59) | EPHX2NR1H4ALDH1A1SRD5A2RXRA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20020115092-A1 | Energy transfer labels with mechanically linked fluorophores | THE SCRIPPS RESEARCH INSTITUTE | 2002-08-22 | — | — | US | disclosed |
| WO-2002040701-A2 | ENERGY TRANSFER LABELS WITH MECHANICALLY LINKED FLUOROPHORES | THE SCRIPPS RESEARCH INSTITUTE (US) | 2002-05-23 | — | — | WO | disclosed |