Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.37 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.37 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.37 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.37 |
| ▸ | KCND3 | Q9UK17 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | TEAD4 | Q15561 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11872592 | 0.81 | EPHX1 (0.53) | CYP1A2ALDH1A1KDM4ESLC6A2SLC6A4 | |
| SCHEMBL4055323 | 0.77 | TSHR (0.44) | CYP1A2ALDH1A1KDM4ESLC6A2SLC6A4 | |
| SCHEMBL7126297 | 0.77 | SLC6A2 (0.44) | CYP1A2ALDH1A1KDM4ESLC6A2SLC6A4 | |
| SCHEMBL27228935 | 0.77 | ALDH1A1 (0.45) | CYP1A2ALDH1A1KDM4ESLC6A2SLC6A4 | |
| SCHEMBL14630051 | 0.76 | SMN1; SMN2 (0.49) | CYP1A2ALDH1A1KDM4ETSHRKCNA5 | |
| SCHEMBL24015882 | 0.75 | ALDH1A1 (0.44) | CYP1A2ALDH1A1KDM4ESLC6A3TSHR | |
| SCHEMBL19322907 | 0.75 | ALDH1A1 (0.44) | CYP1A2ALDH1A1KDM4ESLC6A3TSHR | |
| SCHEMBL24015880 | 0.75 | ALDH1A1 (0.44) | CYP1A2ALDH1A1KDM4ESLC6A3TSHR | |
| SCHEMBL12259473 | 0.75 | TSHR (0.42) | CYP1A2ALDH1A1KDM4ESLC6A2SLC6A4 | |
| SCHEMBL16919267 | 0.74 | CYP1A2 (0.42) | CYP1A2ALDH1A1KDM4ESLC6A2SLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023072974-A1 | TRICYCLIC HETEROCYCLES | MERCK PATENT GMBH (DE) | 2023-05-04 | — | — | WO | disclosed |
| WO-2021224291-A1 | TRICYCLIC HETEROCYCLES USEFUL AS TEAD BINDERS | MERCK PATENT GMBH (DE) | 2021-11-11 | — | — | WO | disclosed |