Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | IDO1 | P14902 | 6/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | PTGDR2 | Q9Y5Y4 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28659540 | 1.00 | PKM (0.54) | PKMIDO1KDM4EPTGDR2ALDH1A1 | |
| SCHEMBL28670159 | 0.80 | LMNA (0.62) | KDM4EPTGDR2ALDH1A1HPGDSLC22A12 | |
| SCHEMBL29878581 | 0.80 | LMNA (0.62) | KDM4EPTGDR2ALDH1A1HPGDSLC22A12 | |
| SCHEMBL2112736 | 0.78 | KDM4E (0.58) | KDM4EPTGDR2ALDH1A1HPGDTDP1 | |
| Benzene SCHEMBL1532355 | 0.78 | KDM4E (0.46) | PKMKDM4EPTGDR2ALDH1A1HPGD | |
| SCHEMBL9799138 | 0.78 | TDP1 (0.50) | KDM4EPTGDR2ALDH1A1HPGDTDP1 | |
| SCHEMBL4209653 | 0.77 | KDR (0.46) | IDO1PDGFRAKDR | |
| SCHEMBL15309635 | 0.77 | SRC (0.55) | PDGFRAKDRPOLBSMN1; SMN2 | |
| SCHEMBL3984932 | 0.76 | TDP1 (0.46) | KDM4EPTGDR2ALDH1A1HPGDTDP1 | |
| SCHEMBL11727493 | 0.76 | GAK (0.61) | IDO1CYP3A4PDGFRAKDR |
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-113788835-B | Triazole tetrazine compound containing morpholine and quinoline ring and preparation method and application thereof | 台州职业技术学院 | 2022-08-26 | — | — | CN | disclosed |