Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 11/20 | 0.72 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.61 |
| ▸ | TSHR | P16473 | 3/20 | 0.61 |
| ▸ | LMNA | P02545 | 2/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.61 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.61 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.61 |
| ▸ | CNR1 | P21554 | 2/20 | 0.60 |
| ▸ | CNR2 | P34972 | 2/20 | 0.60 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.60 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.60 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.60 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.59 |
| ▸ | CA12 | O43570 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL9513638 | 0.94 | ESR1 (0.76) | ESR1CYP1A2CYP2C19TSHRLMNA | |
| SCHEMBL5168199 | 0.90 | CYP1A2 (0.70) | ESR1CYP1A2CYP2C19TSHRLMNA | |
| SCHEMBL5164901 | 0.89 | ESR1 (0.77) | ESR1CYP1A2CYP2C19TSHRLMNA | |
| SCHEMBL16325360 | 0.88 | CA12 (0.68) | ESR1CYP1A2CYP2C19TSHRLMNA | |
| SCHEMBL22289821 | 0.88 | ESR1 (0.74) | ESR1CYP1A2CYP2C19TSHRLMNA | |
| SCHEMBL23250562 | 0.87 | ESR1 (0.67) | ESR1CYP1A2CYP2C19TSHRLMNA | |
| SCHEMBL7592525 | 0.87 | ESR1 (0.73) | ESR1CYP1A2CYP2C19TSHRLMNA | |
| SCHEMBL27893069 | 0.87 | ESR1 (0.67) | ESR1CYP1A2CYP2C19TSHRLMNA | |
| SCHEMBL3404899 | 0.87 | ESR1 (0.72) | ESR1CYP1A2CYP2C19TSHRLMNA | |
| SCHEMBL20250739 | 0.87 | CNR1 (0.72) | ESR1CYP1A2CYP2C19TSHRLMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-113412286-A | Process for preparing polydienes having reduced cold flow properties | 普利司通美国轮胎运营有限责任公司 | 2021-09-17 | — | — | CN | claimed |
| CN-113412286-A | Process for preparing polydienes having reduced cold flow properties | 普利司通美国轮胎运营有限责任公司 | 2021-09-17 | — | — | CN | disclosed |