Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.43 |
| ▸ | MGAM | O43451 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | SI | P14410 | 1/20 | 0.39 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.39 |
| ▸ | KIF11 | P52732 | 1/20 | 0.39 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.35 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.35 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.35 |
| ▸ | VCP | P55072 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 4/20 | 0.34 |
| ▸ | MAOB | P27338 | 4/20 | 0.34 |
| ▸ | KDM1A | O60341 | 2/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15023129 | 0.85 | KIF11 (0.46) | AKR1C3AKR1C2MGAMGAASI | |
| SCHEMBL2571093 | 0.81 | AKR1C3 (0.67) | AKR1C3AKR1C2GAAPTPN1MAOA | |
| SCHEMBL2571095 | 0.81 | AKR1C3 (0.67) | AKR1C3AKR1C2GAAPTPN1MAOA | |
| SCHEMBL16960237 | 0.75 | KDM1A (0.37) | AKR1C3AKR1C2MGAMGAASI | |
| SCHEMBL361060 | 0.75 | ALDH1A1 (0.50) | MGAMGAASIMGAM2KIF11 | |
| SCHEMBL17157940 | 0.75 | AKR1C3 (0.50) | AKR1C3AKR1C2GAAPTPN1MAOA | |
| SCHEMBL17157941 | 0.75 | AKR1C3 (0.50) | AKR1C3AKR1C2GAAPTPN1MAOA | |
| SCHEMBL14957662 | 0.72 | TBXAS1 (0.40) | AKR1C3AKR1C2MGAMGAASI | |
| SCHEMBL14957661 | 0.72 | TBXAS1 (0.40) | AKR1C3AKR1C2MGAMGAASI | |
| SCHEMBL30834416 | 0.72 | TRPA1 (0.44) | AKR1C3MGAMGAASIMGAM2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1199974-C | Spiro (2H-1-benzopyran-2,4'-piperididine) derivates as glycine transport inhibitors | AKZO NOBEL NV (NL) | 2005-05-04 | — | — | CN | disclosed |
| CN-1390221-A | Spiro (2H-1-benzopyran-2,4'-piperididine) derivates as glycine transport inhibitors | AKZO NOBEL NV (NL) | 2003-01-08 | — | — | CN | disclosed |