Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.50 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 4/20 | 0.46 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.46 |
| ▸ | ABAT | P80404 | 1/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HTR3A | P46098 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL10910029 | 0.86 | ESR1 (0.42) | ESR1ESR2HPGDCA2CAMK2A | |
| SCHEMBL915744 | 0.82 | PGK1 (0.57) | ESR1ESR2CA2CAMK2AABAT | |
| SCHEMBL10910361 | 0.80 | ESR1 (0.46) | ESR1ESR2CA2CAMK2AABAT | |
| SCHEMBL916962 | 0.77 | PGK1 (0.52) | ESR1ESR2PTPN1 | |
| SCHEMBL914686 | 0.77 | ESR1 (0.61) | ESR1ESR2PTPN1 | |
| SCHEMBL10253270 | 0.75 | CALM1 (0.41) | ESR1ESR2CA2CAMK2AABAT | |
| Butane SCHEMBL27352790 | 0.75 | ENPP2 (0.59) | ESR1ESR2PTPN1KDM4EALDH1A1 | |
| SCHEMBL10945197 | 0.74 | CYP2C19 (0.45) | HPGDCA2ALDH1A1CYP2C19TAAR1 | |
| SCHEMBL11325744 | 0.74 | IDO1 (0.46) | HPGDKDM4EALDH1A1SLC6A2CYP2C19 | |
| SCHEMBL11609260 | 0.73 | PTPN1 (0.43) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5728468-A | EPOXY RESIN NETWORKS AND ALLYL GROUP MONOMERS | AKZO NOBEL N.V. (NL) | 1998-03-17 | — | — | US | disclosed |
| EP-0614470-B1 | PHOSPOROUS CONTAINING RESIN | AKZO NOBEL NV (NL) | 1996-06-12 | — | — | EP | disclosed |