Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.61 |
| ▸ | PKM | P14618 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.56 |
| ▸ | ATM | Q13315 | 1/20 | 0.56 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 3/20 | 0.54 |
| ▸ | RAB9A | P51151 | 3/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.54 |
| ▸ | MAOB | P27338 | 1/20 | 0.54 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.54 |
| ▸ | RELA | Q04206 | 1/20 | 0.54 |
| ▸ | STAT3 | P40763 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | RECQL | P46063 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL2120414 | 0.89 | ALDH1A1 (0.68) | PKMCTNNB1MAPTNPC1RAB9A | |
| SCHEMBL30039654 | 0.89 | ALDH1A1 (0.68) | PKMCTNNB1MAPTNPC1RAB9A | |
| SCHEMBL6621631 | 0.81 | TSHR (0.65) | TSHRPKMKDM4EATMCTNNB1 | |
| Formaldehyde SCHEMBL27289523 | 0.81 | MAPK1 (0.72) | TSHRPKMKDM4EATMCTNNB1 | |
| SCHEMBL619634 | 0.81 | MAPK1 (0.78) | TSHRPKMKDM4EATMCTNNB1 | |
| SCHEMBL2496047 | 0.79 | TSHR (0.72) | TSHRPKMKDM4EATMCTNNB1 | |
| SCHEMBL4824992 | 0.79 | NPSR1 (0.74) | TSHRPKMKDM4EATMCTNNB1 | |
| SCHEMBL999704 | 0.79 | TSHR (0.61) | TSHRPKMKDM4EATMCTNNB1 | |
| SCHEMBL29383324 | 0.79 | TSHR (0.61) | TSHRPKMKDM4EATMCTNNB1 | |
| SCHEMBL2807412 | 0.76 | KDM4E (0.72) | TSHRPKMKDM4EATMCTNNB1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112939778-B | Coumarin compound ester derivatives, preparation method and application thereof | 西北农林科技大学 | 2022-08-02 | — | — | CN | claimed |
| CN-112939778-A | Coumarin compound ester derivatives, preparation method and application thereof | 西北农林科技大学 | 2021-06-11 | — | — | CN | claimed |
| CN-111918881-B | Novel photocrosslinkable alginic acid derivative | 持田制药株式会社 | 2022-08-12 | — | — | CN | disclosed |
| CN-112939778-B | Coumarin compound ester derivatives, preparation method and application thereof | 西北农林科技大学 | 2022-08-02 | — | — | CN | disclosed |
| CN-112939778-A | Coumarin compound ester derivatives, preparation method and application thereof | 西北农林科技大学 | 2021-06-11 | — | — | CN | disclosed |
| CN-111918881-A | Novel photocrosslinkable alginic acid derivative | 持田制药株式会社 | 2020-11-10 | — | — | CN | disclosed |