Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 6/20 | 0.69 |
| ▸ | CHRNA4 | P43681 | 6/20 | 0.69 |
| ▸ | BCHE | P06276 | 2/20 | 0.58 |
| ▸ | CHRNB4 | P30926 | 6/20 | 0.57 |
| ▸ | CHRNA3 | P32297 | 6/20 | 0.57 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.54 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.54 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.54 |
| ▸ | LTA4H | P09960 | 1/20 | 0.54 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.54 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | MAOB | P27338 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL5363808 | 0.94 | LTA4H (0.61) | CHRNB2CHRNA4BCHECHRNB4CHRNA3 | |
| SCHEMBL5370678 | 0.87 | CHRM4 (0.63) | SLC6A2SLC6A4LTA4HCHRM4MAOB | |
| SCHEMBL14425270 | 0.82 | CHRM4 (0.53) | CHRNB2CHRNA4SLC6A2SLC6A4LTA4H | |
| SCHEMBL5368709 | 0.82 | CHRM4 (0.53) | CHRNB2CHRNA4SLC6A2SLC6A4LTA4H | |
| SCHEMBL5368664 | 0.80 | DRD4 (0.54) | CHRNB2CHRNA4EPHX2CHRM4KDM4E | |
| SCHEMBL5365173 | 0.80 | ADRB1 (0.54) | CHRNB2CHRNA4CHRM4 | |
| SCHEMBL5378277 | 0.80 | HDAC3 (0.71) | BCHECHRM4KMT2A | |
| SCHEMBL7973018 | 0.78 | CHRNB2 (0.62) | CHRNB2CHRNA4CHRNB4CHRNA3SLC6A2 | |
| SCHEMBL8363043 | 0.78 | BCHE (0.75) | CHRNB2CHRNA4BCHECHRM4KDM4E | |
| SCHEMBL28747644 | 0.77 | CHRNB4 (0.62) | CHRNB2CHRNA4CHRNB4CHRNA3SLC6A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7259157-B2 | N-substituted nonaryl-heterocyclo amidyl NMDA/NR2B Antagonists | MERCK & CO., INC. (US) | 2007-08-21 | — | — | US | disclosed |
| US-7259157-B2 | N-substituted nonaryl-heterocyclo amidyl NMDA/NR2B Antagonists | MERCK & CO., INC. (US) | 2007-08-21 | — | — | US | disclosed |
| US-7259157-B2 | N-substituted nonaryl-heterocyclo amidyl NMDA/NR2B Antagonists | MERCK & CO., INC. (US) | 2007-08-21 | — | — | US | disclosed |