Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | FTO | Q9C0B1 | 2/20 | 0.33 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15712209 | 0.85 | FTO (0.34) | HTTALDH1A1HTR7MAPTMEN1 | |
| SCHEMBL17060287 | 0.82 | NQO2 (0.38) | CYP1A2HTTPOLBALDH1A1HTR7 | |
| SCHEMBL15712684 | 0.81 | NPC1 (0.45) | HTTALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL15712771 | 0.81 | SIGMAR1 (0.37) | HTTPOLBHTR7MAPTMEN1 | |
| SCHEMBL17067701 | 0.80 | TSHR (0.36) | HTTPOLBALDH1A1MAPTMEN1 | |
| SCHEMBL15712186 | 0.79 | CYP1A2 (0.37) | CYP1A2HTTPOLBALDH1A1HTR7 | |
| SCHEMBL17060379 | 0.78 | PTGDR2 (0.42) | POLBALDH1A1MAPTMEN1LMNA | |
| SCHEMBL15732879 | 0.74 | NQO2 (0.37) | HTTPOLBALDH1A1HTR7MAPT | |
| SCHEMBL2420811 | 0.74 | CYP1A2 (0.53) | CYP1A2HTR7MAPTMEN1LMNA | |
| SCHEMBL17060321 | 0.73 | CYP1A2 (0.33) | CYP1A2POLBALDH1A1HTR7MAPT |
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-2915804-A1 | NOVEL AMINE DERIVATIVE OR SALT THEREOF | Toyama Chemical Co., Ltd. (JP) | 2015-09-09 | — | — | EP | disclosed |