Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFKB1 | P19838 | 3/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.44 |
| ▸ | RELA | Q04206 | 3/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 3/20 | 0.40 |
| ▸ | HTR1D | P28221 | 3/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6049929 | 0.80 | HTR1A (0.66) | HTR1AHTR1D | |
| SCHEMBL6049991 | 0.78 | HTR1A (0.66) | HTR1AHTR1D | |
| SCHEMBL8045568 | 0.77 | NFKB1 (0.68) | NFKB1NFKB2RELADRD2DRD4 | |
| SCHEMBL8045482 | 0.76 | HTR1A (0.70) | HTR1AHTR1D | |
| SCHEMBL8035083 | 0.76 | DRD2 (0.35) | NFKB1NFKB2RELADRD2DRD4 | |
| Hydrochloric Acid SCHEMBL8970254 | 0.75 | DRD2 (0.34) | NFKB1NFKB2RELADRD2DRD4 | |
| SCHEMBL8052654 | 0.75 | HTR1A (0.66) | HTR1AHTR1D | |
| SCHEMBL8864373 | 0.75 | HTR1A (0.66) | HTR1AHTR1D | |
| SCHEMBL8048742 | 0.74 | HTR1A (0.70) | HTR1AHTR1D | |
| SCHEMBL7201732 | 0.74 | NFKB1 (0.33) | NFKB1NFKB2RELADRD2DRD4 |
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-0714396-B1 | VASOCONTRICTIVE DIHYDROBENZOPYRAN DERIVATIVES | JANSSEN PHARMACEUTICA NV (BE) | 2003-12-10 | — | — | EP | disclosed |
| US-6100268-A | MIGRAINES | JANSSEN PHARMACEUTICA, N.V. (BE) | 2000-08-08 | — | — | US | disclosed |