Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNQ3 | O43525 | 14/20 | 0.39 |
| ▸ | KCNQ2 | O43526 | 14/20 | 0.39 |
| ▸ | KCNE1 | P15382 | 11/20 | 0.39 |
| ▸ | KCNQ1 | P51787 | 11/20 | 0.39 |
| ▸ | MET | P08581 | 1/20 | 0.37 |
| ▸ | CLK1 | P49759 | 1/20 | 0.36 |
| ▸ | EPHB3 | P54753 | 1/20 | 0.35 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3846961 | 0.89 | TRPV1 (0.47) | METCLK1TRPV1IDO1 | |
| SCHEMBL3846730 | 0.88 | IDO1 (0.40) | METCLK1IDO1 | |
| SCHEMBL3845229 | 0.87 | SMN1; SMN2 (0.46) | METCLK1 | |
| SCHEMBL3850679 | 0.86 | CA12 (0.40) | METCLK1TRPV1 | |
| SCHEMBL3855212 | 0.86 | THRB (0.46) | CLK1TRPV1 | |
| SCHEMBL3846174 | 0.86 | EPHB3 (0.39) | METCLK1EPHB3 | |
| SCHEMBL3850098 | 0.86 | EPHB3 (0.39) | METCLK1EPHB3 | |
| SCHEMBL3847490 | 0.86 | MAPT (0.40) | METCLK1EPHB3 | |
| SCHEMBL3848245 | 0.86 | CLK1 (0.41) | METCLK1EPHB3 | |
| SCHEMBL3845861 | 0.85 | NPC1 (0.40) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2048142-A2 | Nitrogen-containing condensed cyclic compound having a pyrazolyl group as a substituent group and pharmaceutical composition thereof | Eisai R&D Management Co., Ltd. (JP) | 2009-04-15 | — | — | EP | disclosed |
| EP-1382603-B1 | NITROGENOUS FUSED-RING COMPOUND HAVING PYRAZOLYL GROUP AS SUBSTITUENT AND MEDICINAL COMPOSITION THEREOF | EISAI R&D MAN CO LTD (JP) | 2008-07-23 | — | — | EP | disclosed |
| US-7074801-B1 | Nitrogen-containing condensed cyclic compound having a pyrazolyl group as a substituent group and pharmaceutical composition thereof | EISAI CO., LTD. (JP) | 2006-07-11 | — | — | US | disclosed |
| EP-1382603-A1 | NITROGENOUS FUSED−RING COMPOUND HAVING PYRAZOLYL GROUP AS SUBSTITUENT AND MEDICINAL COMPOSITION THEREOF | Eisai Co., Ltd. (JP) | 2004-01-21 | — | — | EP | disclosed |