Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NNMT | P40261 | 11/20 | 1.00 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | JAK3 | P52333 | 2/20 | 0.32 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.32 |
| ▸ | JAK2 | O60674 | 1/20 | 0.32 |
| ▸ | JAK1 | P23458 | 1/20 | 0.32 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL25788116 | 1.00 | NNMT (1.00) | NNMTPARP1JAK3RPS6KB1JAK2 | |
| SCHEMBL25787923 | 1.00 | NNMT (1.00) | NNMTPARP1JAK3RPS6KB1JAK2 | |
| SCHEMBL25425377 | 0.84 | NNMT (1.00) | NNMTPARP1JAK3JAK2JAK1 | |
| SCHEMBL25789869 | 0.73 | NNMT (0.57) | NNMT | |
| SCHEMBL25787743 | 0.73 | NNMT (1.00) | NNMTSIRT3TDP1 | |
| SCHEMBL25790280 | 0.72 | NNMT (0.56) | NNMTPARP1JAK3JAK2JAK1 | |
| SCHEMBL25790281 | 0.72 | NNMT (0.56) | NNMTPARP1JAK3JAK2JAK1 | |
| SCHEMBL25790278 | 0.72 | NNMT (0.56) | NNMTPARP1JAK3JAK2JAK1 | |
| SCHEMBL25791697 | 0.72 | NNMT (0.56) | NNMTPARP1JAK3JAK2JAK1 | |
| SCHEMBL25788380 | 0.72 | NNMT (0.56) | NNMTPARP1JAK3JAK2JAK1 |
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-2023129512-A1 | BICYCLIC INHIBITORS OF NICOTINAMIDE N-METHYLTRANSFERASE, COMPOSITIONS AND USES THEREOF | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2023-07-06 | — | — | WO | disclosed |