Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 7/20 | 0.50 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | AR | P10275 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.50 |
| ▸ | HTR6 | P50406 | 1/20 | 0.50 |
| ▸ | ESRRG | P62508 | 1/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | CA12 | O43570 | 4/20 | 0.45 |
| ▸ | CA1 | P00915 | 4/20 | 0.45 |
| ▸ | CA2 | P00918 | 4/20 | 0.45 |
| ▸ | CA7 | P43166 | 4/20 | 0.45 |
| ▸ | CA9 | Q16790 | 4/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 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 | |
|---|---|---|---|---|
| Bisphenol A SCHEMBL10736475 | 1.00 | ESR1 (0.50) | ESR1ESR2CYP3A4ARHPGD | |
| Bisphenol A SCHEMBL30920911 | 0.83 | ESR1 (0.57) | ESR1ESR2CYP3A4ARHPGD | |
| Phenol SCHEMBL29082253 | 0.82 | ALDH1A1 (0.49) | ESR1ESR2TSHRALDH1A1CA12 | |
| Bisphenol A SCHEMBL3081593 | 0.81 | ESR1 (0.50) | ESR1ESR2CYP3A4ARHPGD | |
| Bisphenol A SCHEMBL31303881 | 0.80 | ESR1 (0.57) | ESR1ESR2CYP3A4ARHPGD | |
| Bisphenol A SCHEMBL30620172 | 0.79 | ESR1 (0.55) | ESR1ESR2CYP3A4ARHPGD | |
| Bisphenol A SCHEMBL22319407 | 0.78 | ESR1 (0.64) | ESR1ESR2CYP3A4ARHPGD | |
| Bisphenol A SCHEMBL4219076 | 0.78 | ESR1 (0.64) | ESR1ESR2CYP3A4ARHPGD | |
| Bisphenol A SCHEMBL347900 | 0.78 | ESR1 (0.64) | ESR1ESR2CYP3A4ARHPGD | |
| Bisphenol A SCHEMBL9147592 | 0.78 | ESR1 (0.64) | ESR1ESR2CYP3A4ARHPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-113318798-B | Micro-column array micro-fluidic chip for lossless capture of liquid drops and preparation method and application thereof | 浙江大学 | 2022-10-25 | — | — | CN | disclosed |