Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.42 |
| ▸ | F10 | P00742 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CCR2 | P41597 | 1/20 | 0.39 |
| ▸ | GHSR | Q92847 | 1/20 | 0.38 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 2/20 | 0.37 |
| ▸ | HTR2A | P28223 | 2/20 | 0.37 |
| ▸ | HTR7 | P34969 | 2/20 | 0.37 |
| ▸ | HTR6 | P50406 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10143533 | 0.88 | MEN1 (0.52) | CA2CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL5953051 | 0.77 | CA2 (0.49) | CA2AKR1B1F10ALDH1A1CYP2A6 | |
| SCHEMBL329294 | 0.74 | CA2 (0.71) | CA2AKR1B1CYP2A6CCR2CA1 | |
| SCHEMBL8799012 | 0.74 | CA2 (0.46) | CA2AKR1B1F10ALDH1A1CYP2A6 | |
| SCHEMBL21442199 | 0.73 | CA2 (0.51) | CA2AKR1B1F10CYP2A6CCR2 | |
| SCHEMBL12818659 | 0.72 | PIK3CD (0.42) | CA2F10 | |
| SCHEMBL329449 | 0.72 | CA2 (0.69) | CA2AKR1B1CYP2A6CCR2CA1 | |
| SCHEMBL25119616 | 0.71 | CA2 (0.67) | CA2AKR1B1CYP2A6CCR2CA1 | |
| SCHEMBL743918 | 0.71 | CA2 (0.67) | CA2AKR1B1CYP2A6CCR2CA1 | |
| SCHEMBL792780 | 0.71 | CA2 (1.00) | CA2CA1CA9 |
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-2012009258-A2 | PEPTIDOMIMETIC GALANIN RECEPTOR MODULATORS | ROBERTS EDWARD (US) | 2012-01-19 | — | — | WO | disclosed |