Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 3/20 | 0.56 |
| ▸ | DRD2 | P14416 | 2/20 | 0.47 |
| ▸ | DRD3 | P35462 | 2/20 | 0.47 |
| ▸ | DRD4 | P21917 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.44 |
| ▸ | CDK2 | P24941 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.43 |
| ▸ | KDM5A | P29375 | 1/20 | 0.41 |
| ▸ | SLC34A1 | Q06495 | 1/20 | 0.40 |
| ▸ | SLC34A3 | Q8N130 | 1/20 | 0.40 |
| ▸ | NOS3 | P29474 | 2/20 | 0.40 |
| ▸ | NOS1 | P29475 | 2/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.39 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5315582 | 0.84 | NOS2 (0.64) | NOS2DRD2DRD3DRD4MEN1 | |
| SCHEMBL12440506 | 0.81 | NOS2 (0.62) | NOS2DRD2DRD3DRD4CCNA2 | |
| Hydrochloric Acid SCHEMBL27710837 | 0.79 | NOS2 (0.60) | NOS2DRD2DRD3DRD4CCNA2 | |
| SCHEMBL1307498 | 0.79 | NOS2 (0.54) | NOS2DRD2DRD3DRD4MEN1 | |
| SCHEMBL3359734 | 0.79 | DRD2 (0.71) | NOS2DRD2DRD3DRD4HRH3 | |
| SCHEMBL1307715 | 0.78 | NOS2 (0.53) | NOS2DRD2DRD3DRD4MEN1 | |
| SCHEMBL11777245 | 0.77 | SIGMAR1 (0.56) | NOS2DRD2DRD3DRD4HRH3 | |
| SCHEMBL25894349 | 0.77 | NOS2 (0.65) | NOS2DRD2DRD3DRD4MEN1 | |
| SCHEMBL526424 | 0.77 | NOS2 (0.55) | NOS2MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL11773957 | 0.76 | SIGMAR1 (0.55) | NOS2DRD2DRD3DRD4HRH3 |
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-7605176-B2 | β-ketoamide compounds with MCH antagonistic activity | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-10-20 | — | — | US | disclosed |
| US-7605176-B2 | β-ketoamide compounds with MCH antagonistic activity | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-10-20 | — | — | US | disclosed |
| US-7592373-B2 | Amide compounds with MCH antagonistic activity and medicaments comprising these compounds | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-09-22 | — | — | US | disclosed |