Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD1 | P21728 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | DRD5 | P21918 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6556400 | 0.85 | HTR2A (0.37) | SIGMAR1HTR2AHTR2CHTR2B | |
| SCHEMBL6556390 | 0.85 | HTR2A (0.37) | SIGMAR1HTR2AHTR2CHTR2B | |
| SCHEMBL6556316 | 0.85 | HTR2A (0.37) | SIGMAR1HTR2AHTR2CHTR2B | |
| SCHEMBL6556396 | 0.85 | HTR2A (0.37) | SIGMAR1HTR2AHTR2CHTR2B | |
| Fumaric Acid SCHEMBL7868759 | 0.77 | TSHR (0.35) | HTR2AHTR2CHTR2B | |
| Fumaric Acid SCHEMBL6556317 | 0.77 | TSHR (0.35) | HTR2AHTR2CHTR2B | |
| Fumaric Acid SCHEMBL6556476 | 0.77 | TSHR (0.35) | HTR2AHTR2CHTR2B | |
| SCHEMBL6557759 | 0.72 | DRD2 (0.43) | SIGMAR1DRD2DRD1DRD4DRD5 | |
| SCHEMBL6557750 | 0.72 | DRD2 (0.43) | SIGMAR1DRD2DRD1DRD4DRD5 | |
| SCHEMBL6557779 | 0.72 | MEN1 (0.36) | — |
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-6310208-B1 | Serotonin receptor binding benzo[e]isoindoles and benzo[h]isoquinolines | HOFFMANN-LA ROCHE INC. | 2001-10-30 | — | — | US | claimed |
| EP-0958285-B1 | TRICYCLIC BENZO[e]ISOINDOLES AND BENZO[h]ISOQUINOLINES | HOFFMANN LA ROCHE (CH) | 2004-01-07 | — | — | EP | disclosed |
| US-6310208-B1 | Serotonin receptor binding benzo[e]isoindoles and benzo[h]isoquinolines | HOFFMANN-LA ROCHE INC. | 2001-10-30 | — | — | US | disclosed |