Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 3/20 | 0.66 |
| ▸ | PDK2 | Q15119 | 3/20 | 0.66 |
| ▸ | PDK3 | Q15120 | 3/20 | 0.66 |
| ▸ | PDK4 | Q16654 | 3/20 | 0.66 |
| ▸ | MEN1 | O00255 | 4/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.58 |
| ▸ | RAB9A | P51151 | 1/20 | 0.58 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.53 |
| ▸ | IDO1 | P14902 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7470294 | 0.86 | MEN1 (0.74) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL6351013 | 0.80 | PDK1 (0.65) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL2388970 | 0.77 | EPHX1 (0.70) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL5150505 | 0.77 | MEN1 (0.67) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL28738831 | 0.75 | PDK1 (0.56) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL19853109 | 0.75 | PDK1 (0.62) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL1092575 | 0.74 | MEN1 (0.69) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL9836674 | 0.74 | MEN1 (0.69) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL8397618 | 0.74 | PDK1 (0.54) | PDK1PDK2PDK3PDK4MEN1 | |
| SCHEMBL13453209 | 0.74 | MEN1 (0.62) | PDK1PDK2PDK3PDK4MEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5977027-A | NITROGEN CONTAINING CYCLIC COMPOUND | NISSAN CHEMICAL INDUSTRIES, LTD. (JP) | 1999-11-02 | — | — | US | disclosed |
| US-5834401-A | WIDE VARIETY OF NITROGEN CONTAINING HETEROCYCLES, CLAIMED COMPOUND IS A PIPERIDONE DERIVATIVE OF ISOBUTYRAMIDE | NISSAN CHEMICAL INDUSTRIES, LTD. (JP) | 1998-11-10 | — | — | US | disclosed |
| EP-0747352-A1 | CYCLIC NITROGENOUS COMPOUND AND HERBICIDE | NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) | 1996-12-11 | — | — | EP | disclosed |