Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MLYCD | O95822 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | NSD2 | O96028 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.34 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1009189 | 0.83 | NSD2 (0.45) | CHRNB2CHRNB4CHRNA3CHRNA4MAOB | |
| SCHEMBL8771989 | 0.83 | MMP2 (0.45) | CHRNB2CHRNB4CHRNA3CHRNA4MAOB | |
| SCHEMBL6424007 | 0.81 | NSD2 (0.43) | MAOBNSD2CHRM2CHRM1CHRM3 | |
| SCHEMBL7465397 | 0.76 | TSHR (0.44) | CHRNB2CHRNB4CHRNA3CHRNA4MAOB | |
| SCHEMBL2586342 | 0.76 | SLC6A2 (0.44) | MLYCDCHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL2578969 | 0.76 | NSD2 (0.41) | MLYCDCHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL7233237 | 0.74 | NSD2 (0.53) | SLC6A4NSD2CHRM2CHRM1CHRM3 | |
| SCHEMBL10712025 | 0.74 | ANPEP (0.41) | — | |
| SCHEMBL8773630 | 0.73 | SLC7A5 (0.36) | — | |
| SCHEMBL1737432 | 0.72 | AKT1 (0.42) | CHRNB2CHRNB4CHRNA3CHRNA4 |
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 |
|---|---|---|---|---|---|---|---|
| US-20030153506-A1 | Combination product comprising melagatran and factor VIIa inhibitor | ASTRAZENECA AB (SE) | 2003-08-14 | — | — | US | disclosed |