Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 7/20 | 0.38 |
| ▸ | CA2 | P00918 | 7/20 | 0.38 |
| ▸ | CA12 | O43570 | 4/20 | 0.38 |
| ▸ | CA9 | Q16790 | 4/20 | 0.38 |
| ▸ | SPHK1 | Q9NYA1 | 4/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.36 |
| ▸ | DPP8 | Q6V1X1 | 2/20 | 0.35 |
| ▸ | DPP7 | Q9UHL4 | 2/20 | 0.35 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.35 |
| ▸ | MARS1 | P56192 | 1/20 | 0.32 |
| ▸ | LTA4H | P09960 | 1/20 | 0.32 |
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.32 |
| ▸ | MET | P08581 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7963555 | 0.88 | CA1 (0.41) | CA1CA2CA12CA9 | |
| Hydrochloric Acid SCHEMBL7975014 | 0.81 | DPP8 (0.47) | DPP8DPP7DPP9LTA4H | |
| SCHEMBL7977030 | 0.79 | CA1 (0.47) | CA1CA2CA12CA9DPP8 | |
| SCHEMBL7973817 | 0.78 | CA2 (0.37) | CA1CA2CA12CA9 | |
| SCHEMBL7974904 | 0.78 | DPP7 (0.35) | CA1CA2CA12CA9DPP8 | |
| SCHEMBL7963487 | 0.74 | CA12 (0.41) | CA1CA2CA12CA9 | |
| SCHEMBL7974865 | 0.74 | CA12 (0.41) | CA1CA2CA12CA9 | |
| SCHEMBL934762 | 0.73 | GSR (0.48) | — | |
| SCHEMBL6130709 | 0.73 | DPP7 (0.34) | DPP8DPP7DPP9LTA4H | |
| SCHEMBL7974900 | 0.73 | GSR (0.48) | — |
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-2001005748-A1 | OLIGOMERIC AMINO ACID DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | MONSANTO COMPANY (US) | 2001-01-25 | — | — | WO | disclosed |