Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.30 |
| ▸ | NOS1 | P29475 | 1/20 | 0.30 |
| ▸ | NOS2 | P35228 | 1/20 | 0.30 |
| ▸ | PI4KA | P42356 | 1/20 | 0.30 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.30 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.30 |
| ▸ | PI4KB | Q9UBF8 | 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 | |
|---|---|---|---|---|
| Pyridine SCHEMBL27650868 | 0.92 | TSHR (0.39) | TSHRNAPRTTDP1NOS3NOS1 | |
| Pyrrole SCHEMBL1931942 | 0.88 | — | — | |
| Pyridine SCHEMBL28113018 | 0.84 | F7 (0.35) | TSHRNAPRTTDP1 | |
| Benzene SCHEMBL28271534 | 0.82 | KDM4E (0.32) | TSHRNOS3NOS1NOS2PI4KA | |
| Pyrimidine SCHEMBL5591459 | 0.80 | HSP90AA1 (0.38) | NOS3NOS1NOS2PI4KAPI4K2B | |
| Pyridine SCHEMBL28081844 | 0.77 | TSHR (0.56) | TSHRNAPRTTDP1 | |
| SCHEMBL28238027 | 0.77 | — | — | |
| SCHEMBL956 | 0.77 | — | — | |
| Dalfampridine SCHEMBL9113268 | 0.76 | MAPT (0.56) | TSHR | |
| Pyridine SCHEMBL28396009 | 0.75 | TSHR (0.47) | TSHRNAPRTTDP1 |
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-106170294-A | Antibacterial combinations containing polymyxins | 斯佩罗旋转酶公司 | 2016-11-30 | — | — | CN | disclosed |