Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 7/20 | 0.36 |
| ▸ | HTR1B | P28222 | 3/20 | 0.36 |
| ▸ | DRD2 | P14416 | 5/20 | 0.36 |
| ▸ | HTR2A | P28223 | 3/20 | 0.36 |
| ▸ | HTR1A | P08908 | 2/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.35 |
| ▸ | NNMT | P40261 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 3/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL26101504 | 0.76 | NNMT (0.44) | HTR1DDRD2HTR2AHTR1ADRD4 | |
| SCHEMBL1075684 | 0.71 | DRD3 (0.44) | HTR1DHTR1BDRD2MEN1KMT2A | |
| SCHEMBL31511358 | 0.70 | ALDH1A1 (0.40) | MEN1KMT2AHPGDHSD11B1 | |
| SCHEMBL31511366 | 0.70 | ALDH1A1 (0.40) | MEN1KMT2AHPGDHSD11B1 | |
| SCHEMBL1026289 | 0.69 | OPRM1 (0.36) | MEN1KMT2A | |
| SCHEMBL7389468 | 0.68 | MEN1 (0.42) | DRD2MEN1KMT2ADRD3 | |
| SCHEMBL20504355 | 0.68 | MAPKAPK2 (0.44) | DRD2MEN1KMT2AMAPKAPK2NNMT | |
| SCHEMBL20504221 | 0.68 | PRCP (0.53) | DRD2DRD4MEN1KMT2AMAPKAPK2 | |
| SCHEMBL26452181 | 0.68 | PARP10 (0.58) | MEN1KMT2ACYP2C9HPGD | |
| SCHEMBL1025073 | 0.66 | F2 (0.43) | — |
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-2274283-A1 | NOVEL N-SUBSTITUTED TETRAHYDROISOQUINOLINE/ISOINDOLINE HYDROXAMIC ACID COMPOUNDS | 4SC AG (DE) | 2011-01-19 | — | — | EP | disclosed |
| WO-2009112550-A1 | NOVEL N-SUBSTITUTED TETRAHYDROISOQUINOLINE/ISOINDOLINE HYDROXAMIC ACID COMPOUNDS | 4SC AG (DE) | 2009-09-17 | — | — | WO | disclosed |