Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 6/20 | 0.48 |
| ▸ | CNR1 | P21554 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | BRD4 | O60885 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | BRD2 | P25440 | 1/20 | 0.39 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.39 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.37 |
| ▸ | PARP3 | Q9Y6F1 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6304721 | 0.92 | KDM4E (0.47) | CNR2CNR1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL6305637 | 0.82 | CNR2 (0.48) | CNR2CNR1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL16982382 | 0.81 | CNR2 (0.54) | CNR2CNR1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL6302526 | 0.80 | CNR2 (0.38) | CNR2CNR1KDM4EALDH1A1BRD4 | |
| SCHEMBL6302527 | 0.80 | KDM4E (0.49) | CNR2CNR1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL6304261 | 0.78 | KDM4E (0.45) | CNR2CNR1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL29820590 | 0.78 | PARP1 (0.52) | CNR2CNR1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL15327919 | 0.76 | SMN1; SMN2 (0.54) | CNR2CNR1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL20003608 | 0.75 | ALDH1A1 (0.45) | CNR2CNR1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL6302792 | 0.75 | KDM4E (0.47) | CNR2CNR1KDM4EALDH1A1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6949562-B2 | Heterocyclic compounds as ligands of the GABAA receptor | NEUROGEN CORPORATION (US) | 2005-09-27 | — | — | US | disclosed |