Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NNMT | P40261 | 7/20 | 1.00 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.38 |
| ▸ | CRBN | Q96SW2 | 2/20 | 0.37 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.35 |
| ▸ | OGA | O60502 | 1/20 | 0.34 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL25787741 | 0.90 | NNMT (1.00) | NNMTPIK3C3CRBNGRM5CHRNB2 | |
| SCHEMBL5306512 | 0.86 | NNMT (0.75) | NNMTKDM4EMAPTPIK3C3CRBN | |
| SCHEMBL21782980 | 0.81 | NNMT (0.68) | NNMTKDM4EMAPTPIK3C3CRBN | |
| SCHEMBL30968499 | 0.81 | NNMT (0.68) | NNMTKDM4EMAPTCYP11B2PIK3C3 | |
| SCHEMBL20722588 | 0.81 | NNMT (0.68) | NNMTKDM4EMAPTCYP11B2PIK3C3 | |
| SCHEMBL22226400 | 0.79 | NNMT (0.64) | NNMTKDM4ECYP11B2CRBNGRM5 | |
| SCHEMBL22226923 | 0.77 | NNMT (0.63) | NNMTKDM4E | |
| SCHEMBL25787851 | 0.77 | NNMT (0.62) | NNMTGRM5CHRNB2CHRNA4 | |
| SCHEMBL25787975 | 0.77 | NNMT (0.66) | NNMTKDM4ECHRNB2CHRNA4SMN1; SMN2 | |
| SCHEMBL21772832 | 0.77 | NNMT (0.62) | NNMTKDM4EMAPTCYP11B2PIK3C3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110869363-B | 5-membered and bicyclic heterocyclic amides as ROCK inhibitors | 百时美施贵宝公司 | 2024-01-05 | — | — | CN | disclosed |
| 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 |