Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 6/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | F2RL1 | P55085 | 3/20 | 0.31 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.31 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.31 |
| ▸ | CSNK1E | P49674 | 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 | |
|---|---|---|---|---|
| SCHEMBL13157082 | 0.78 | HRH4 (0.40) | CSNK1DCSNK1E | |
| SCHEMBL28193478 | 0.77 | CCNB2 (0.36) | CYP1A2ALDH1A1KDM4EHTTSMN1; SMN2 | |
| SCHEMBL7444508 | 0.77 | KDM4E (0.36) | ALDH1A1KDM4EHTTSMN1; SMN2F2RL1 | |
| SCHEMBL28193856 | 0.74 | HTT (0.36) | CYP1A2ALDH1A1KDM4EHTTSMN1; SMN2 | |
| SCHEMBL28193295 | 0.74 | CCNB2 (0.33) | CYP1A2ALDH1A1KDM4EHTT | |
| SCHEMBL10688108 | 0.74 | HTT (0.37) | GRIN2BALDH1A1KDM4ELCKHTT | |
| SCHEMBL7022293 | 0.73 | CHEK1 (0.37) | ALDH1A1KDM4EHTT | |
| SCHEMBL7456245 | 0.72 | — | — | |
| SCHEMBL4061481 | 0.71 | MGAM (0.40) | GRIN2BALDH1A1SMN1; SMN2 | |
| SCHEMBL28193885 | 0.70 | TXNRD1 (0.39) | CYP1A2ALDH1A1KDM4EHTT |
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-1165557-A1 | ARYL AND HETEROARYL FUSED AMINOALKYL-IMIDAZOLE DERIVATIVES: SELECTIVE MODULATORS OF GABAa RECEPTORS | NEUROGEN CORPORATION (US) | 2002-01-02 | — | — | EP | disclosed |
| WO-2000059905-A1 | ARYL AND HETEROARYL FUSED AMINOALKYL-IMIDAZOLE DERIVATIVES: SELECTIVE MODULATORS OF GABAa RECEPTORS | NEUROGEN CORPORATION (US) | 2000-10-12 | — | — | WO | disclosed |