Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFKB1 | P19838 | 1/20 | 0.68 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.68 |
| ▸ | RELA | Q04206 | 1/20 | 0.68 |
| ▸ | DRD2 | P14416 | 15/20 | 0.65 |
| ▸ | DRD4 | P21917 | 15/20 | 0.65 |
| ▸ | DRD3 | P35462 | 15/20 | 0.65 |
| ▸ | DRD1 | P21728 | 2/20 | 0.58 |
| ▸ | DRD5 | P21918 | 2/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL8312005 | 0.79 | DRD2 (1.00) | NFKB1NFKB2RELADRD2DRD4 | |
| SCHEMBL7203555 | 0.77 | NFKB1 (0.44) | NFKB1NFKB2RELADRD2DRD4 | |
| SCHEMBL8864198 | 0.77 | DRD2 (0.72) | NFKB1NFKB2RELADRD2DRD4 | |
| SCHEMBL5640879 | 0.77 | DRD2 (0.72) | NFKB1NFKB2RELADRD2DRD4 | |
| SCHEMBL8864160 | 0.77 | DRD2 (0.72) | NFKB1NFKB2RELADRD2DRD4 | |
| Bromide SCHEMBL6281511 | 0.76 | DRD2 (0.70) | NFKB1NFKB2RELADRD2DRD4 | |
| SCHEMBL7116091 | 0.74 | NFKB1 (0.57) | NFKB1NFKB2RELADRD2DRD4 | |
| SCHEMBL7116097 | 0.74 | NFKB1 (0.57) | NFKB1NFKB2RELADRD2DRD4 | |
| SCHEMBL8844842 | 0.73 | DRD2 (1.00) | DRD2DRD4DRD3DRD1DRD5 | |
| SCHEMBL6049929 | 0.73 | HTR1A (0.66) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6100268-A | MIGRAINES | JANSSEN PHARMACEUTICA, N.V. (BE) | 2000-08-08 | — | — | US | disclosed |
| EP-0714396-A1 | VASOCONTRICTIVE DIHYDROBENZOPYRAN DERIVATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 1996-06-05 | — | — | EP | disclosed |
| WO-1995005383-A1 | VASOCONTRICTIVE DIHYDROBENZOPYRAN DERIVATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 1995-02-23 | — | — | WO | disclosed |