Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.51 |
| ▸ | KMO | O15229 | 6/20 | 0.47 |
| ▸ | MCHR1 | Q99705 | 5/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | MCHR2 | Q969V1 | 4/20 | 0.43 |
| ▸ | PDE1C | Q14123 | 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 | |
|---|---|---|---|---|
| SCHEMBL4898390 | 0.80 | TRPV1 (0.52) | NOTUMKMOMAOAMAOBPDE1C | |
| SCHEMBL3980684 | 0.73 | HTR2A (0.47) | KMOPDE1C | |
| SCHEMBL29037804 | 0.73 | KMO (0.55) | KMO | |
| SCHEMBL29520376 | 0.73 | KMO (0.55) | KMO | |
| SCHEMBL13516619 | 0.71 | PLA2G4A (0.49) | KMOMAOAMAOB | |
| SCHEMBL9112586 | 0.71 | MCHR1 (0.49) | MCHR1MAOAMAOBMCHR2 | |
| SCHEMBL3492199 | 0.70 | MAOA (0.50) | KMOMAOAMAOBPDE1C | |
| SCHEMBL28490404 | 0.69 | ALDH1A1 (0.50) | NOTUMPDE1C | |
| SCHEMBL29522898 | 0.69 | ALDH1A1 (0.50) | NOTUMPDE1C | |
| SCHEMBL16686040 | 0.69 | NPC1 (0.63) | NOTUMMAOAMAOBPDE1C |
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-2009058924-A1 | CCR5 ANTAGONISTS AS THERAPEUTIC AGENTS | SMITHKLINE BEECHAM CORPORATION (US) | 2009-05-07 | — | — | WO | disclosed |