Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.33 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4256410 | 0.84 | ESR1 (0.47) | ESR1ESR2ALDH1A1TDP1TP53 | |
| SCHEMBL15051454 | 0.80 | ESR1 (0.57) | ESR1ESR2ALDH1A1TDP1TP53 | |
| SCHEMBL107334 | 0.79 | ALDH1A1 (0.46) | ESR1ALDH1A1TDP1TP53CYP3A4 | |
| SCHEMBL4649854 | 0.76 | ESR1 (0.67) | ESR1ESR2TDP1CYP3A4ALOX15 | |
| SCHEMBL27776614 | 0.73 | IDO1 (0.44) | ESR1ESR2ALDH1A1TDP1TP53 | |
| SCHEMBL30374755 | 0.73 | ESR1 (0.58) | ESR1ESR2ALDH1A1TDP1TP53 | |
| SCHEMBL14276990 | 0.73 | SKP2 (0.45) | ESR1ESR2ALDH1A1TDP1CYP3A4 | |
| SCHEMBL1100456 | 0.72 | ESR1 (0.63) | ESR1ESR2ALDH1A1TDP1CYP3A4 | |
| SCHEMBL5949977 | 0.72 | ESR1 (0.63) | ESR1ESR2ALDH1A1TDP1CYP3A4 | |
| SCHEMBL311572 | 0.72 | ESR1 (0.63) | ESR1ESR2ALDH1A1TDP1CYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4933423-A | Thermosetting resin compositions | SHELL OIL COMPANY (US) | 1990-06-12 | — | — | US | claimed |
| US-5001213-A | Thermosetting resin compositions | SHELL OIL COMPANY (US) | 1991-03-19 | — | — | US | disclosed |
| US-4933423-A | Thermosetting resin compositions | SHELL OIL COMPANY (US) | 1990-06-12 | — | — | US | disclosed |