Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 2/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.30 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.30 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28872836 | 0.74 | CA1 (0.32) | CA12CA14CA1CA2CA7 | |
| SCHEMBL20657366 | 0.73 | CA1 (0.31) | NOS1NOS3NOS2CA1CA2 | |
| SCHEMBL11875307 | 0.72 | KMT2A (0.34) | NOS1NOS3NOS2CA1CA2 | |
| SCHEMBL21929526 | 0.69 | — | — | |
| SCHEMBL25764373 | 0.67 | — | — | |
| SCHEMBL27471646 | 0.67 | — | — | |
| SCHEMBL29708406 | 0.66 | DGAT1 (0.40) | CA1CA2CA7DGAT1 | |
| Isopropyl Alcohol SCHEMBL27636953 | 0.66 | NOS1 (0.38) | NOS1NOS3NOS2CA12CA14 | |
| SCHEMBL3073411 | 0.66 | — | — | |
| SCHEMBL4376025 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0641769-A1 | AMINO ACID DERIVATIVE | SANKYO COMPANY LIMITED (JP) | 1995-03-08 | — | — | EP | disclosed |