Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 14/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.38 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.37 |
| ▸ | TNF | P01375 | 1/20 | 0.36 |
| ▸ | LITAF | Q99732 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3687413 | 1.00 | ADORA2A (0.42) | ADORA2AHTTHTR1AADRA1DADRA1A | |
| SCHEMBL3691984 | 0.82 | DRD4 (0.40) | ADORA2AHTR1AADRA1DADRA1AADRA1B | |
| SCHEMBL3685798 | 0.81 | HTR1A (0.38) | ADORA2AHTTHTR1AADRA1DADRA1A | |
| SCHEMBL3688301 | 0.81 | ADORA2A (0.36) | ADORA2AHTTHTR1AADRA1DADRA1A | |
| SCHEMBL3685796 | 0.79 | SLC2A1 (0.53) | ADRA1A | |
| SCHEMBL3694581 | 0.79 | SLC2A1 (0.53) | ADRA1A | |
| SCHEMBL5652953 | 0.79 | SLC2A1 (0.53) | ADRA1A | |
| SCHEMBL5319073 | 0.77 | KCNH2 (0.51) | — | |
| SCHEMBL5266900 | 0.77 | SLC2A1 (0.40) | HTT | |
| SCHEMBL5435565 | 0.75 | KCNH2 (0.40) | ADORA2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2239260-A1 | Novel compounds with antibacterial activity | Morphochem Aktiengesellschaft Für Kombinatorische Chemie (DE) | 2010-10-13 | — | — | EP | disclosed |
| EP-1551829-A2 | NOVEL COMPOUNDS WITH ANTIBACTERIAL ACTIVITY | Morphochem Aktiengesellschaft Für Kombinatorische Chemie (DE) | 2005-07-13 | — | — | EP | disclosed |
| WO-2004035569-A2 | NOVEL COMPOUNDS WITH ANTIBACTERIAL ACTIVITY | Morphochem Aktiengesellschaft für kombinatorische Chemie (DE) | 2004-04-29 | — | — | WO | disclosed |