Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA5 | P22460 | 5/20 | 0.43 |
| ▸ | DPP4 | P27487 | 2/20 | 0.43 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 5/20 | 0.40 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.38 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.38 |
| ▸ | CCNK | O75909 | 1/20 | 0.38 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2B6 | P20813 | 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 | |
|---|---|---|---|---|
| SCHEMBL31038075 | 0.80 | PTGS2 (0.56) | KCNA5CYP11B1CYP11B2PTGS2CYP2A6 | |
| Benzylamine SCHEMBL28224987 | 0.78 | CYP2A6 (0.53) | KCNA5LOXL2CYP11B1CYP11B2PTGS2 | |
| Benzylamine SCHEMBL28225657 | 0.78 | CYP2A6 (0.55) | KCNA5LOXL2CYP11B1CYP11B2PTGS2 | |
| SCHEMBL28182272 | 0.77 | PTGS2 (0.54) | KCNA5CYP11B1CYP11B2PTGS2CYP2A6 | |
| SCHEMBL3288789 | 0.75 | DPP4 (0.62) | KCNA5DPP4LOXL2CYP11B1CYP11B2 | |
| Biphenyl SCHEMBL27783277 | 0.75 | PTGS2 (0.59) | KCNA5CYP11B1CYP11B2PTGS2CYP2A6 | |
| Benzene SCHEMBL9109284 | 0.75 | PTGS2 (0.62) | KCNA5CYP11B1CYP11B2PTGS2CYP2A6 | |
| Benzene SCHEMBL28446151 | 0.75 | PTGS2 (0.62) | KCNA5CYP11B1CYP11B2PTGS2CYP2A6 | |
| Benzene SCHEMBL15456827 | 0.75 | PTGS2 (0.62) | KCNA5CYP11B1CYP11B2PTGS2CYP2A6 | |
| SCHEMBL28860785 | 0.74 | CYP2A6 (0.62) | LOXL2CYP11B1CYP11B2PTGS2CYP2A6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108165261-A | A kind of multicolor luminous gel based on terpyridine ligand and preparation method and application | 南京邮电大学 | 2018-06-15 | — | — | CN | claimed |
| CN-108165261-A | A kind of multicolor luminous gel based on terpyridine ligand and preparation method and application | 南京邮电大学 | 2018-06-15 | — | — | CN | disclosed |