Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.34 |
| ▸ | GABRA2 | P47869 | 5/20 | 0.32 |
| ▸ | GABRB2 | P47870 | 5/20 | 0.32 |
| ▸ | IDH1 | O75874 | 3/20 | 0.32 |
| ▸ | GRM5 | P41594 | 2/20 | 0.31 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.31 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.31 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.31 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7853789 | 0.81 | POLB (0.44) | GPBAR1 | |
| SCHEMBL5089304 | 0.76 | GPBAR1 (0.34) | GPBAR1HCAR1GABRA2GABRB2IDH1 | |
| SCHEMBL5089196 | 0.68 | GABRA2 (0.35) | LMNAGABRA2GABRB2IDH1GRM1 | |
| SCHEMBL5093728 | 0.68 | KDM4E (0.36) | IDH1PIK3CAPIK3CBPIK3CG | |
| SCHEMBL28634259 | 0.58 | P2RX7 (0.41) | LMNAHCAR1GABRA2GABRB2GRM5 | |
| SCHEMBL16983113 | 0.57 | ALDH1A1 (0.40) | GPBAR1LMNACYP2C9HCAR1 | |
| SCHEMBL17764736 | 0.57 | NOTUM (0.40) | LMNAHCAR1CYP11B2HTT | |
| SCHEMBL1547622 | 0.57 | TDP1 (0.56) | LMNA | |
| SCHEMBL5173711 | 0.56 | IDO1 (0.49) | LMNACYP1A2CYP2C9CYP2C19HCAR1 | |
| SCHEMBL19953169 | 0.56 | CYP3A4 (0.43) | GPBAR1MEN1KMT2A |
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-1317433-A2 | INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 | CHIRON CORPORATION (US) | 2003-06-11 | — | — | EP | disclosed |
| WO-2002020495-A2 | INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 | CHIRON CORPORATION (US) | 2002-03-14 | — | — | WO | disclosed |