Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 4/20 | 0.50 |
| ▸ | MAOA | P21397 | 2/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1691673 | 0.83 | MAOB (0.54) | MAOBMAOACYP19A1TSHRMAPK1 | |
| SCHEMBL15778664 | 0.83 | MAOB (0.54) | MAOBMAOACYP19A1TSHRMAPK1 | |
| SCHEMBL6617434 | 0.81 | SLC6A2 (0.61) | MAOBMAOACYP19A1TSHRMAPK1 | |
| SCHEMBL20752033 | 0.79 | ACHE (0.50) | MAOBCYP3A4TAAR1CYP11B1CYP11B2 | |
| SCHEMBL14341098 | 0.79 | MAOB (0.50) | MAOBMAOACYP19A1TSHRMAPK1 | |
| SCHEMBL23682536 | 0.78 | MAOB (0.48) | MAOBMAOACYP19A1TSHRMAPK1 | |
| SCHEMBL3432534 | 0.77 | MRGPRX4 (0.48) | MAOBMAOACYP19A1TSHRMAPK1 | |
| SCHEMBL29299444 | 0.76 | MAOB (0.47) | MAOBMAOACYP19A1TSHRMAPK1 | |
| SCHEMBL23682585 | 0.76 | MAOB (0.47) | MAOBMAOACYP19A1TSHRMAPK1 | |
| SCHEMBL7361271 | 0.75 | SLC6A2 (0.58) | TSHRCYP3A4RECQLSLC6A2TAAR1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2799431-B1 | NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF | FUJIFILM CORP (JP) | 2018-01-24 | — | — | EP | disclosed |