Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | INPPL1 | O15357 | 1/20 | 0.35 |
| ▸ | ACP3 | P15309 | 2/20 | 0.33 |
| ▸ | RXRA | P19793 | 1/20 | 0.33 |
| ▸ | RXRB | P28702 | 1/20 | 0.33 |
| ▸ | PTPN5 | P54829 | 4/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | CA4 | P22748 | 1/20 | 0.32 |
| ▸ | CA5A | P35218 | 1/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.32 |
| ▸ | BCR | P11274 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 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 | |
|---|---|---|---|---|
| SCHEMBL601374 | 0.84 | TSHR (0.50) | ESR1LMNATSHRHPGDCA2 | |
| SCHEMBL345474 | 0.82 | TSHR (0.48) | ESR1LMNATSHRHPGDCA2 | |
| SCHEMBL345063 | 0.82 | LMNA (0.48) | ESR1LMNATSHRHPGDCA2 | |
| SCHEMBL31015497 | 0.82 | TSHR (0.48) | ESR1LMNATSHRHPGDCA2 | |
| SCHEMBL27224387 | 0.82 | TSHR (0.48) | ESR1LMNATSHRHPGDCA2 | |
| SCHEMBL344702 | 0.82 | TSHR (0.48) | ESR1LMNATSHRHPGDCA2 | |
| SCHEMBL22064852 | 0.80 | CA2 (0.52) | ESR1LMNATSHRINPPL1ACP3 | |
| SCHEMBL13713762 | 0.77 | CA2 (0.55) | ESR1LMNATSHRHPGDCA2 | |
| SCHEMBL27614826 | 0.75 | LMNA (0.68) | ESR1LMNATSHRHPGDHDAC1 | |
| SCHEMBL12606481 | 0.73 | MMP2 (0.42) | ESR1LMNATSHRHPGDCA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-20190210002-A1 | Porous material for storing of molecules and its use | Institute of Inorganic Chemistry, CAS (CZ) | 2019-07-11 | — | — | US | disclosed |