Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 7/20 | 0.65 |
| ▸ | PTGS1 | P23219 | 6/20 | 0.65 |
| ▸ | MAPT | P10636 | 4/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.59 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.59 |
| ▸ | RECQL | P46063 | 1/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.59 |
| ▸ | HPGD | P15428 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.59 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.59 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.59 |
| ▸ | THPO | P40225 | 1/20 | 0.59 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.59 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL29055589 | 1.00 | PTGS2 (0.65) | PTGS2PTGS1MAPTALDH1A1CXCR1 | |
| Ammonia Solution, Strong SCHEMBL28229773 | 0.97 | PTGS2 (0.62) | PTGS2PTGS1MAPTALDH1A1CXCR1 | |
| SCHEMBL4297790 | 0.85 | CYP19A1 (0.70) | SMN1; SMN2LMNACYP3A4PMP22HSD17B10 | |
| SCHEMBL16517900 | 0.85 | CYP19A1 (0.70) | SMN1; SMN2LMNACYP3A4PMP22HSD17B10 | |
| SCHEMBL10901068 | 0.83 | CYP19A1 (0.73) | SMN1; SMN2LMNACYP3A4PMP22HSD17B10 | |
| SCHEMBL18100905 | 0.83 | PTGS2 (0.60) | PTGS2PTGS1MAPTALDH1A1CXCR1 | |
| SCHEMBL20079537 | 0.82 | PTGS2 (0.78) | PTGS2PTGS1MAPTALDH1A1CXCR1 | |
| Ammonia Solution, Strong SCHEMBL28169433 | 0.81 | CYP19A1 (0.50) | PTGS2PTGS1MAPTALDH1A1LMNA | |
| SCHEMBL6430962 | 0.81 | PTGS2 (0.80) | PTGS2PTGS1MAPTALDH1A1CXCR1 | |
| SCHEMBL13428218 | 0.80 | PTGS2 (0.56) | PTGS2PTGS1MAPTALDH1A1CXCR1 |
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-116606205-A | Synthetic method of ester compound | 浙江工业大学 | 2023-08-18 | — | — | CN | disclosed |