Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | DPP4 | P27487 | 2/20 | 0.42 |
| ▸ | F2 | P00734 | 2/20 | 0.42 |
| ▸ | IDO1 | P14902 | 3/20 | 0.42 |
| ▸ | NOS1 | P29475 | 2/20 | 0.42 |
| ▸ | NOS3 | P29474 | 1/20 | 0.42 |
| ▸ | NOS2 | P35228 | 1/20 | 0.42 |
| ▸ | F10 | P00742 | 1/20 | 0.39 |
| ▸ | F12 | P00748 | 1/20 | 0.39 |
| ▸ | F7 | P08709 | 1/20 | 0.39 |
| ▸ | F3 | P13726 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1537397 | 0.80 | CYP2D6 (0.63) | CYP2D6MAPK1DPP4F2IDO1 | |
| SCHEMBL11568023 | 0.78 | DPP4 (0.42) | DPP4F2ADRA2AADRA2CLMNA | |
| SCHEMBL11568026 | 0.78 | DPP4 (0.42) | DPP4F2ADRA2AADRA2CLMNA | |
| Bromide SCHEMBL5065688 | 0.78 | CYP2D6 (0.61) | CYP2D6MAPK1DPP4F2IDO1 | |
| Bromide SCHEMBL4919111 | 0.75 | CYP2D6 (0.43) | CYP2D6MAPK1DPP4F2IDO1 | |
| Bromide SCHEMBL4917874 | 0.75 | MAPK1 (0.47) | CYP2D6MAPK1IDO1NOS1NOS3 | |
| SCHEMBL21991381 | 0.74 | CYP2D6 (0.45) | CYP2D6MAPK1LMNA | |
| SCHEMBL11500737 | 0.72 | CYP2D6 (0.41) | CYP2D6MAPK1DPP4F2IDO1 | |
| Guanidine SCHEMBL29771736 | 0.72 | DPP4 (0.74) | DPP4F2F10F12F7 | |
| SCHEMBL7046602 | 0.71 | DPP4 (0.55) | DPP4F2ADRA2AADRA2CLMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009012242-A2 | SODIUM CHANNEL INHIBITORS | ICAGEN, INC. (US) | 2009-01-22 | — | — | WO | disclosed |