Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 5/20 | 0.61 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.52 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.51 |
| ▸ | DRD2 | P14416 | 1/20 | 0.51 |
| ▸ | DRD4 | P21917 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | CTSL | P07711 | 1/20 | 0.50 |
| ▸ | CTSB | P07858 | 1/20 | 0.50 |
| ▸ | CTSK | P43235 | 1/20 | 0.50 |
| ▸ | KDM5A | P29375 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL6705226 | 0.85 | HDAC8 (0.56) | SMYD3POLBOPRD1ROCK2CYP3A4 | |
| Hydrochloric Acid SCHEMBL4883454 | 0.85 | MCHR1 (0.64) | SMYD3POLBDRD2DRD4 | |
| Hydrochloric Acid SCHEMBL4602478 | 0.85 | MCHR1 (0.64) | SMYD3POLBDRD2DRD4 | |
| SCHEMBL6164884 | 0.82 | OPRD1 (0.60) | SMYD3POLBOPRD1ROCK2CYP3A4 | |
| SCHEMBL2400255 | 0.81 | DPP4 (0.57) | SMYD3 | |
| SCHEMBL2400261 | 0.81 | DPP4 (0.57) | SMYD3 | |
| SCHEMBL26814547 | 0.80 | NPSR1 (0.60) | POLBNPSR1CTSLCTSBCTSK | |
| SCHEMBL4086820 | 0.79 | HDAC8 (0.59) | POLBOPRD1HDAC8 | |
| SCHEMBL4095232 | 0.79 | HDAC8 (0.59) | POLBOPRD1HDAC8 | |
| SCHEMBL6052747 | 0.79 | HDAC8 (0.59) | POLBOPRD1HDAC8 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1966130-A2 | MODIFIED LYSINE-MIMETIC COMPOUNDS | Zealand Pharma A/S (DK) | 2008-09-10 | — | — | EP | claimed |
| WO-2007078990-A2 | MODIFIED LYSINE-MIMETIC COMPOUNDS | ZEALAND PHARMA A/S (DK) | 2007-07-12 | — | — | WO | claimed |