Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.57 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | HPGD | P15428 | 2/20 | 0.57 |
| ▸ | TSHR | P16473 | 2/20 | 0.57 |
| ▸ | AR | P10275 | 1/20 | 0.57 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.57 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.57 |
| ▸ | HTR6 | P50406 | 1/20 | 0.57 |
| ▸ | ESRRG | P62508 | 1/20 | 0.57 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | SRC | P12931 | 1/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Bisphenol A SCHEMBL30959812 | 0.94 | CYP3A4 (0.50) | ESR1ESR2CYP3A4HPGDTSHR | |
| SCHEMBL1815086 | 0.93 | SRC (0.54) | ESR1ESR2CYP3A4HPGDTSHR | |
| Bisphenol A SCHEMBL1610315 | 0.92 | SRC (0.61) | ESR1ESR2CYP3A4HPGDTSHR | |
| SCHEMBL2719596 | 0.87 | ESR1 (0.50) | ESR1ESR2CYP3A4HPGDTSHR | |
| SCHEMBL15946722 | 0.86 | ESR1 (0.57) | ESR1ESR2CYP3A4HPGDTSHR | |
| SCHEMBL16672004 | 0.86 | ESR1 (0.57) | ESR1ESR2CYP3A4HPGDTSHR | |
| SCHEMBL17880398 | 0.86 | ESR1 (0.57) | ESR1ESR2CYP3A4HPGDTSHR | |
| SCHEMBL5077474 | 0.86 | SRC (0.62) | ESR1ESR2CYP3A4MEN1KMT2A | |
| SCHEMBL131227 | 0.84 | SRC (0.62) | ESR1ESR2MEN1KMT2AKDM4E | |
| SCHEMBL27501261 | 0.84 | SRC (0.60) | ESR1ESR2CYP3A4MEN1KMT2A |
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-5408280-A | Process for rendering contact lenses hydrophilic | CIBA-GEIGY CORPORATION (US) | 1995-04-18 | — | — | US | disclosed |