Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 1/20 | 0.35 |
| ▸ | F10 | P00742 | 4/20 | 0.34 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | JAK2 | O60674 | 1/20 | 0.32 |
| ▸ | JAK1 | P23458 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.31 |
| ▸ | DRD3 | P35462 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL876281 | 0.91 | F10 (0.37) | F10DRD2POLBADORA2AADORA1 | |
| SCHEMBL878508 | 0.79 | F10 (0.34) | CCR5F10MCHR1DRD2POLB | |
| SCHEMBL876715 | 0.78 | CCR5 (0.37) | CCR5F10MCHR1POLBADORA2A | |
| SCHEMBL878300 | 0.78 | CCR5 (0.35) | CCR5F10MCHR1DRD2POLB | |
| SCHEMBL877422 | 0.77 | F10 (0.34) | CCR5F10MCHR1DRD2POLB | |
| SCHEMBL877924 | 0.77 | F10 (0.36) | F10DRD2POLB | |
| SCHEMBL785118 | 0.77 | MCHR1 (0.44) | CCR5F10MCHR1DRD2POLB | |
| SCHEMBL785119 | 0.77 | MCHR1 (0.44) | CCR5F10MCHR1DRD2POLB | |
| SCHEMBL876437 | 0.77 | F10 (0.33) | CCR5F10MCHR1POLBJAK2 | |
| SCHEMBL786234 | 0.76 | CCR5 (0.40) | CCR5F10MCHR1DRD2POLB |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2619178-A1 | SUBSTITUTED BENZAMIDE COMPOUNDS | Grünenthal GmbH (DE) | 2013-07-31 | — | — | EP | claimed |
| WO-2012038081-A1 | SUBSTITUTED BENZAMIDE COMPOUNDS | Grünenthal GmbH (DE) | 2012-03-29 | — | — | WO | claimed |
| EP-2619178-A1 | SUBSTITUTED BENZAMIDE COMPOUNDS | Grünenthal GmbH (DE) | 2013-07-31 | — | — | EP | disclosed |
| WO-2012038081-A1 | SUBSTITUTED BENZAMIDE COMPOUNDS | Grünenthal GmbH (DE) | 2012-03-29 | — | — | WO | disclosed |