Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 2/20 | 0.66 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.66 |
| ▸ | DRD2 | P14416 | 11/20 | 0.66 |
| ▸ | DRD4 | P21917 | 11/20 | 0.66 |
| ▸ | DRD3 | P35462 | 11/20 | 0.66 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.60 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.60 |
| ▸ | CHRM5 | P08912 | 4/20 | 0.60 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.60 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.60 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.60 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.60 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.60 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.60 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.60 |
| ▸ | HTR1A | P08908 | 2/20 | 0.60 |
| ▸ | HTR7 | P34969 | 2/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL6978625 | 0.94 | GRIN1 (0.58) | GRIN1GRIN2BDRD2DRD4DRD3 | |
| SCHEMBL6715989 | 0.94 | DRD2 (0.59) | GRIN1GRIN2BDRD2DRD4DRD3 | |
| SCHEMBL6711688 | 0.88 | HRH4 (0.52) | GRIN1GRIN2BDRD2DRD4DRD3 | |
| SCHEMBL6715832 | 0.84 | HTR1A (0.63) | DRD2DRD4DRD3HTR1AHTR7 | |
| SCHEMBL7082418 | 0.84 | DRD2 (0.65) | DRD2DRD3CHRM1HTR1AHTR7 | |
| SCHEMBL6971856 | 0.82 | HTR1A (0.50) | CHRM1HTR1AHTR7 | |
| SCHEMBL7087322 | 0.81 | HRH4 (0.51) | DRD2DRD4DRD3ADRA1DADRA1A | |
| SCHEMBL7084667 | 0.81 | HRH4 (0.51) | GRIN1GRIN2BDRD2DRD4DRD3 | |
| SCHEMBL6970561 | 0.80 | CHRM1 (0.48) | DRD2DRD4DRD3CHRM1HTR1A | |
| SCHEMBL8831449 | 0.80 | DRD2 (0.69) | DRD2DRD3CHRM2CHRM1ADRA1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1296954-A1 | BICYCLIC LACTAMS AND SULFONAMIDES WITH 5-HT1A-AFFINITY AND USE THEREOF FOR PREVENTING AND TREATING CEREBRAL ISCHAEMIA | Abbott GmbH & Co. KG (DE) | 2003-04-02 | — | — | EP | disclosed |
| WO-2002002529-A1 | BICYCLIC LACTAMS AND SULFONAMIDES WITH 5-HT1A-AFFINITY AND USE THEREOF FOR PREVENTING AND TREATING CEREBRAL ISCHAEMIA | ABBOTT GMBH & CO. KG (DE) | 2002-01-10 | — | — | WO | disclosed |