Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | ENPP2 | Q13822 | 3/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 4/20 | 0.41 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.41 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14425317 | 0.85 | MEN1 (0.50) | MEN1KMT2ANPSR1ENPP2GRIN2B | |
| SCHEMBL14425436 | 0.85 | MEN1 (0.50) | MEN1KMT2ANPSR1ENPP2GRIN2B | |
| SCHEMBL5368740 | 0.85 | MEN1 (0.50) | MEN1KMT2ANPSR1ENPP2GRIN2B | |
| SCHEMBL5362821 | 0.85 | ENPP2 (0.48) | MEN1KMT2ANPSR1ENPP2GRIN2B | |
| SCHEMBL14425339 | 0.85 | ENPP2 (0.48) | MEN1KMT2ANPSR1ENPP2GRIN2B | |
| SCHEMBL14425425 | 0.84 | CYP1A2 (0.49) | MEN1KMT2AENPP2GRIN2BACKR3 | |
| SCHEMBL5367318 | 0.84 | CYP1A2 (0.49) | MEN1KMT2AENPP2GRIN2BACKR3 | |
| SCHEMBL5371038 | 0.82 | GRIN2B (0.55) | GRIN2BCYP2C19CYP2C9CYP3A4NPC1 | |
| SCHEMBL5370645 | 0.81 | DRD4 (0.46) | MEN1KMT2AACKR3CYP2C19CYP1A2 | |
| SCHEMBL5374908 | 0.80 | ENPP2 (0.48) | MEN1KMT2ANPSR1ENPP2GRIN2B |
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 |