Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRC | P12931 | 1/20 | 0.41 |
| ▸ | SLC13A5 | Q86YT5 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.32 |
| ▸ | BAD | Q92934 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
| ▸ | KIF11 | P52732 | 1/20 | 0.31 |
| ▸ | CCR4 | P51679 | 1/20 | 0.31 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | F2 | P00734 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10912802 | 0.93 | SRC (0.46) | SRCSLC13A5TSHRCA2GABRA1 | |
| SCHEMBL14410377 | 0.85 | CA2 (0.40) | SRCTSHRCA2GABRA1GABRB2 | |
| SCHEMBL7508670 | 0.77 | SRC (0.45) | SRCSLC13A5HTR2CHTR2B | |
| SCHEMBL15946718 | 0.77 | SRC (0.44) | SRCSLC13A5TSHRBCL2L1BAD | |
| Hydrochloric Acid SCHEMBL27853380 | 0.76 | SRC (0.44) | SRCSLC13A5HTR2CHTR2BALDH1A1 | |
| SCHEMBL27418884 | 0.76 | CA2 (0.41) | TSHRCA2GABRA1GABRB2KIF11 | |
| SCHEMBL19684568 | 0.73 | PNMT (0.44) | BCL2L1BADHTR2CHTR2B | |
| SCHEMBL4567536 | 0.72 | SRC (0.35) | SRC | |
| SCHEMBL25590825 | 0.72 | SRC (0.35) | SRCSLC13A5TSHRHTR2CHTR2B | |
| SCHEMBL24604599 | 0.72 | BCL2L1 (0.50) | TSHRCA2BCL2L1BADGABRA1 |
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-9701774-B2 | Metallocene compound and method of preparing the same | LG CHEM, LTD. (KR) | 2017-07-11 | — | — | US | disclosed |