Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.69 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.44 |
| ▸ | FDPS | P14324 | 1/20 | 0.44 |
| ▸ | EPHB3 | P54753 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 6/20 | 0.42 |
| ▸ | RAB9A | P51151 | 6/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | FLT3 | P36888 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.39 |
| ▸ | MIF | P14174 | 1/20 | 0.38 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2587965 | 0.81 | NPSR1 (1.00) | NPSR1GGPS1FDPSEPHB3NPC1 | |
| SCHEMBL496758 | 0.70 | NPC1 (0.60) | NPSR1GGPS1FDPSEPHB3NPC1 | |
| Hydrochloric Acid SCHEMBL21834227 | 0.69 | NPC1 (0.59) | NPSR1GGPS1FDPSEPHB3NPC1 | |
| SCHEMBL3836508 | 0.68 | NPC1 (0.57) | NPSR1GGPS1FDPSEPHB3NPC1 | |
| Phosphoric Acid SCHEMBL29440774 | 0.68 | NPC1 (0.54) | NPSR1GGPS1FDPSEPHB3NPC1 | |
| SCHEMBL2591865 | 0.68 | NPSR1 (1.00) | NPSR1NPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL14756611 | 0.67 | NPC1 (0.53) | NPSR1GGPS1FDPSEPHB3NPC1 | |
| SCHEMBL16797995 | 0.67 | DDR2 (0.69) | EPHB3NPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL11266749 | 0.67 | NPC1 (0.78) | NPSR1EPHB3NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL30552182 | 0.67 | EPHB3 (0.63) | GGPS1FDPSEPHB3NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011137220-A1 | SMALL MOLECULE NEUROPEPTIDE S ANTAGONISTS FOR THE TREATMENT OF ADDICTIVE DISORDERS, MOOD, ANXIETY AND SLEEP DISORDERS | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2011-11-03 | — | — | WO | disclosed |
| WO-2011137220-A1 | SMALL MOLECULE NEUROPEPTIDE S ANTAGONISTS FOR THE TREATMENT OF ADDICTIVE DISORDERS, MOOD, ANXIETY AND SLEEP DISORDERS | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2011-11-03 | — | — | WO | disclosed |