Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 5/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | CA12 | O43570 | 4/20 | 0.50 |
| ▸ | CA9 | Q16790 | 4/20 | 0.50 |
| ▸ | CA2 | P00918 | 3/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 4/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | CA7 | P43166 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6433794 | 1.00 | NPSR1 (0.54) | NPSR1ALDH1A1CA12CA9CA2 | |
| SCHEMBL7091243 | 1.00 | NPSR1 (0.54) | NPSR1ALDH1A1CA12CA9CA2 | |
| Benzene SCHEMBL7095659 | 0.98 | NPSR1 (0.53) | NPSR1ALDH1A1CA12CA9CA2 | |
| SCHEMBL7095133 | 0.94 | NPSR1 (0.53) | NPSR1ALDH1A1CA12CA9CA2 | |
| SCHEMBL2068561 | 0.94 | ALDH1A1 (0.59) | NPSR1ALDH1A1CA12CA9CA2 | |
| SCHEMBL607797 | 0.94 | ALDH1A1 (0.59) | NPSR1ALDH1A1CA12CA9CA2 | |
| SCHEMBL2067591 | 0.94 | ALDH1A1 (0.59) | NPSR1ALDH1A1CA12CA9CA2 | |
| SCHEMBL2068549 | 0.94 | ALDH1A1 (0.59) | NPSR1ALDH1A1CA12CA9CA2 | |
| SCHEMBL7093232 | 0.89 | MMP2 (0.47) | NPSR1ALDH1A1CA12CA9CA2 | |
| SCHEMBL2242392 | 0.88 | ALDH1A1 (0.54) | NPSR1ALDH1A1CA12CA9CA2 |
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-1736474-A1 | PIPERIDINE DERIVATIVE | KYOWA HAKKO KOGYO CO., LTD. (JP) | 2006-12-27 | — | — | EP | disclosed |