Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 5/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 2/20 | 0.36 |
| ▸ | HTR2C | P28335 | 2/20 | 0.36 |
| ▸ | HTR2B | P41595 | 2/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | DRD1 | P21728 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6556473 | 1.00 | ACHE (0.41) | ACHEBRD4SIGMAR1ADORA3AR | |
| SCHEMBL6556464 | 1.00 | ACHE (0.41) | ACHEBRD4SIGMAR1ADORA3AR | |
| Fumaric Acid SCHEMBL7867817 | 0.89 | HRH2 (0.46) | BRD4MEN1KMT2AHTR2AHTR2C | |
| Fumaric Acid SCHEMBL6558351 | 0.89 | HRH2 (0.46) | BRD4MEN1KMT2AHTR2AHTR2C | |
| Fumaric Acid SCHEMBL6558353 | 0.89 | HRH2 (0.46) | BRD4MEN1KMT2AHTR2AHTR2C | |
| Fumaric Acid SCHEMBL6558349 | 0.89 | HRH2 (0.46) | BRD4MEN1KMT2AHTR2AHTR2C | |
| SCHEMBL6556191 | 0.86 | ACHE (0.51) | ACHESIGMAR1MEN1KMT2AHTR2A | |
| SCHEMBL6556196 | 0.86 | ACHE (0.51) | ACHESIGMAR1MEN1KMT2AHTR2A | |
| SCHEMBL6557809 | 0.80 | MAOB (0.38) | ACHEMEN1KMT2ASLC6A2SLC6A4 | |
| SCHEMBL6557804 | 0.80 | MAOB (0.38) | ACHEMEN1KMT2ASLC6A2SLC6A4 |
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-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 |