Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP12 | P39900 | 3/20 | 0.50 |
| ▸ | MMP13 | P45452 | 2/20 | 0.50 |
| ▸ | MMP2 | P08253 | 1/20 | 0.50 |
| ▸ | MMP9 | P14780 | 1/20 | 0.50 |
| ▸ | MMP14 | P50281 | 1/20 | 0.50 |
| ▸ | PPARG | P37231 | 1/20 | 0.47 |
| ▸ | PPARA | Q07869 | 1/20 | 0.47 |
| ▸ | MME | P08473 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | ACP3 | P15309 | 1/20 | 0.44 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 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 | |
|---|---|---|---|---|
| SCHEMBL26326703 | 0.98 | MMP12 (0.53) | MMP12MMP13MMP2MMP9MMP14 | |
| SCHEMBL19152533 | 0.94 | MMP12 (0.57) | MMP12MMP13MMP2MMP9MMP14 | |
| SCHEMBL19152177 | 0.94 | MMP12 (0.57) | MMP12MMP13MMP2MMP9MMP14 | |
| SCHEMBL936318 | 0.94 | PPARG (0.50) | PPARGPPARALMNAACP3RIPK1 | |
| SCHEMBL19152252 | 0.90 | MMP12 (0.57) | MMP12MMP13MMP2MMP9MMP14 | |
| SCHEMBL477470 | 0.90 | PPARG (0.54) | PPARGPPARALMNAACP3RIPK1 | |
| SCHEMBL5835025 | 0.90 | PPARG (0.54) | PPARGPPARALMNAACP3RIPK1 | |
| SCHEMBL499868 | 0.90 | PPARG (0.54) | PPARGPPARALMNAACP3RIPK1 | |
| SCHEMBL9460360 | 0.86 | ADRA1A (0.56) | LMNACYP2C19SLC6A2SLC6A3CYP3A4 | |
| SCHEMBL19152522 | 0.86 | MMP12 (0.50) | MMP12MMP13MMP2MMP9MMP14 |
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-113354820-B | Chiral polysiloxanes, its synthesis and application | 中国科学院大连化学物理研究所 | 2022-08-19 | — | — | CN | disclosed |