Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NNMT | P40261 | 3/20 | 0.43 |
| ▸ | KDR | P35968 | 9/20 | 0.41 |
| ▸ | RET | P07949 | 3/20 | 0.41 |
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.41 |
| ▸ | LIMK1 | P53667 | 3/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.41 |
| ▸ | DAPK3 | O43293 | 2/20 | 0.41 |
| ▸ | PRKD3 | O94806 | 2/20 | 0.41 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.41 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.41 |
| ▸ | FLT1 | P17948 | 2/20 | 0.41 |
| ▸ | LTK | P29376 | 2/20 | 0.41 |
| ▸ | GRK5 | P34947 | 2/20 | 0.41 |
| ▸ | CSNK1A1 | P48729 | 2/20 | 0.41 |
| ▸ | CDK8 | P49336 | 2/20 | 0.41 |
| ▸ | CDK7 | P50613 | 2/20 | 0.41 |
| ▸ | RPS6KA3 | P51812 | 2/20 | 0.41 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.41 |
| ▸ | TYRO3 | Q06418 | 2/20 | 0.41 |
| ▸ | AURKB | Q96GD4 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2606409 | 0.77 | KDR (0.50) | NNMTKDRRETLRRK2LIMK1 | |
| SCHEMBL30159408 | 0.77 | KDR (0.50) | NNMTKDRRETLRRK2LIMK1 | |
| SCHEMBL31720967 | 0.71 | NNMT (0.48) | NNMTRETLRRK2LIMK1PI4KA | |
| SCHEMBL17362743 | 0.67 | KDR (0.47) | NNMTKDRRETLRRK2LIMK1 | |
| SCHEMBL14498838 | 0.66 | NNMT (0.59) | NNMTKDRPLK1GRM5 | |
| SCHEMBL29201815 | 0.64 | NNMT (0.45) | NNMTKDRRETLRRK2LIMK1 | |
| SCHEMBL30159359 | 0.62 | DRD1 (0.49) | NNMTKDRRETLRRK2LIMK1 | |
| SCHEMBL29487134 | 0.62 | NNMT (0.44) | NNMTKDRRETLRRK2LIMK1 | |
| SCHEMBL3803152 | 0.62 | NNMT (0.44) | NNMTKDRRETLRRK2LIMK1 | |
| SCHEMBL795294 | 0.62 | DRD1 (0.49) | NNMTKDRRETLRRK2LIMK1 |
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-2023129513-A2 | BICYCLIC HETEROAROMATIC INHIBITORS OF NICOTINAMIDE N-METHYLTRANSFERASE, AND COMPOSITIONS AND USES THEREOF | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2023-07-06 | — | — | WO | disclosed |