Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.31 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL11262872 | 1.00 | KMT2A (0.51) | KMT2ADRD2HTR2ADRD3LMNA | |
| Hydrochloric Acid SCHEMBL11261254 | 0.82 | KMT2A (0.37) | KMT2AHTTOPRD1 | |
| Hydrochloric Acid SCHEMBL11261257 | 0.82 | KMT2A (0.37) | KMT2AHTTOPRD1 | |
| SCHEMBL11267573 | 0.81 | EPHX2 (0.39) | KMT2ADRD2HTR2ADRD3TRPV1 | |
| SCHEMBL11264043 | 0.81 | EPHX2 (0.39) | KMT2ADRD2HTR2ADRD3TRPV1 | |
| Hydrochloric Acid SCHEMBL11266301 | 0.79 | KMT2A (0.35) | KMT2ALMNAHTTTRPV1OPRD1 | |
| Hydrochloric Acid SCHEMBL11266305 | 0.79 | KMT2A (0.35) | KMT2ALMNAHTTTRPV1OPRD1 | |
| SCHEMBL11270115 | 0.78 | ALDH1A1 (0.42) | KMT2ALMNATSHRSMN1; SMN2NPSR1 | |
| SCHEMBL11270106 | 0.78 | ALDH1A1 (0.42) | KMT2ALMNATSHRSMN1; SMN2NPSR1 | |
| SCHEMBL11260254 | 0.77 | SMYD3 (0.36) | KMT2AHTTTRPV1EPHX2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4315006-A | Benzoxocin derivatives having anxiolytic and anti-convulsant activities | GLAXO GROUP LIMITED (GB) | 1982-02-09 | — | — | US | disclosed |
| EP-0024843-A1 | 3,4,5,6-Tetrahydro-2,6-methano-4 beta-amino-1-benzoxocin derivatives, process for their preparation and compositions containing them | GLAXO GROUP LIMITED (GB) | 1981-03-11 | — | — | EP | disclosed |