Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 4/20 | 0.46 |
| ▸ | CA12 | O43570 | 3/20 | 0.44 |
| ▸ | CA1 | P00915 | 3/20 | 0.44 |
| ▸ | CA2 | P00918 | 3/20 | 0.44 |
| ▸ | CA9 | Q16790 | 3/20 | 0.44 |
| ▸ | ACVR1 | Q04771 | 4/20 | 0.43 |
| ▸ | FYN | P06241 | 1/20 | 0.41 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.40 |
| ▸ | BMP4 | P12644 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | BMPR1A | P36894 | 1/20 | 0.40 |
| ▸ | ACVRL1 | P37023 | 1/20 | 0.40 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.38 |
| ▸ | AAK1 | Q2M2I8 | 5/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL25523901 | 0.84 | ERN1 (0.37) | ERN1AAK1 | |
| SCHEMBL25521555 | 0.82 | ERN1 (0.50) | ERN1CA12CA1CA2CA9 | |
| SCHEMBL25524007 | 0.79 | PDGFRB (0.40) | ERN1CA1CA2CA9MAPK10 | |
| SCHEMBL25521800 | 0.78 | AAK1 (0.47) | ACVR1AAK1 | |
| SCHEMBL20371605 | 0.77 | KDM4E (0.47) | CA12CA1CA2CA9ACVR1 | |
| SCHEMBL25523958 | 0.76 | NR1H2 (0.46) | AAK1MMP9 | |
| SCHEMBL25521799 | 0.76 | TOP2A (0.40) | KDRAAK1 | |
| SCHEMBL25523899 | 0.76 | AKR1C3 (0.42) | KDR | |
| SCHEMBL25523903 | 0.75 | KDM4E (0.40) | — | |
| SCHEMBL25522058 | 0.75 | ADORA2A (0.50) | ERN1AAK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023086428-A2 | NOVEL MODULATORS OF THE ARYL HYDROCARBON RECEPTOR AND METHODS OF USE THEREOF | ALLIANTHERA (SUZHOU) BIOPHARMACEUTICAL CO., LTD. (CN) | 2023-05-19 | — | — | WO | disclosed |