Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | SLC6A5 | Q9Y345 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | ECE1 | P42892 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CASP2 | P42575 | 1/20 | 0.31 |
| ▸ | KDM4A | O75164 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.30 |
| ▸ | DOHH | Q9BU89 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL9114893 | 0.88 | CA1 (0.41) | TSHRLMNASLC6A5CASP2KDM4A | |
| SCHEMBL9112346 | 0.85 | CA1 (0.35) | ECE1CA1CA2 | |
| SCHEMBL2257886 | 0.78 | — | — | |
| SCHEMBL4760493 | 0.77 | — | — | |
| SCHEMBL9114630 | 0.77 | MEN1 (0.54) | TSHRCYP2C19ALDH1A1CASP2 | |
| SCHEMBL8533062 | 0.76 | TDP1 (0.33) | TSHR | |
| SCHEMBL2897506 | 0.76 | ECE1 (0.56) | TSHRCYP3A4CYP2D6CYP2C19LMNA | |
| SCHEMBL12573540 | 0.76 | TSHR (0.42) | TSHRCYP3A4CYP2D6CYP2C19LMNA | |
| SCHEMBL8531536 | 0.75 | ECE1 (0.36) | TSHRALDH1A1ECE1CASP2 | |
| SCHEMBL12829898 | 0.75 | CASP2 (0.46) | TSHRCYP3A4CYP2D6CYP2C19LMNA |
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-5457134-A | Controlling nematodes, insects, acarids on plants | MONSANTO COMPANY (US) | 1995-10-10 | — | — | US | claimed |