Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP1 | P03956 | 2/20 | 0.42 |
| ▸ | MMP2 | P08253 | 2/20 | 0.42 |
| ▸ | MMP9 | P14780 | 2/20 | 0.42 |
| ▸ | MMP12 | P39900 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | NMT1 | P30419 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3944977 | 0.93 | RXFP1 (0.44) | MMP1MMP2MMP9MMP12CA1 | |
| SCHEMBL3943333 | 0.89 | GPBAR1 (0.46) | CA1CA2TSHR | |
| SCHEMBL3952068 | 0.86 | MEN1 (0.48) | LMNA | |
| SCHEMBL3947411 | 0.85 | MEN1 (0.50) | — | |
| SCHEMBL3952520 | 0.84 | RXFP1 (0.53) | LMNATSHRHTT | |
| SCHEMBL3941781 | 0.84 | TP53 (0.47) | — | |
| SCHEMBL3945382 | 0.84 | TP53 (0.46) | MMP1MMP2MMP9MMP12 | |
| SCHEMBL3950668 | 0.80 | TP53 (0.43) | — | |
| SCHEMBL3944160 | 0.80 | PKM (0.54) | — | |
| SCHEMBL4157885 | 0.80 | LMNA (0.46) | ALDH1A1LMNAPOLBTSHRHTT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009020457-A2 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2009-02-12 | — | — | WO | disclosed |