Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 2/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL4901433 | 1.00 | CTSK (0.33) | CTSKCA1CA2CA7NOS1 | |
| SCHEMBL28705560 | 0.83 | CTSK (0.39) | CTSKCA1CA2CA7NOS1 | |
| SCHEMBL17871166 | 0.82 | CTSK (0.38) | CTSKCA1CA2CA7NOS1 | |
| SCHEMBL28069982 | 0.80 | NOS1 (0.36) | CTSKCA1CA2CA7NOS1 | |
| SCHEMBL27733732 | 0.80 | CTSK (0.33) | CTSKCA1CA2CA7NOS1 | |
| SCHEMBL16574707 | 0.80 | TSHR (0.35) | CTSKCA1CA2CA7NOS1 | |
| SCHEMBL9954495 | 0.80 | TSHR (0.35) | CTSKCA1CA2CA7NOS1 | |
| SCHEMBL28705561 | 0.77 | CTSK (0.35) | CTSKCA1CA2CA7NOS1 | |
| SCHEMBL28950491 | 0.77 | CTSK (0.35) | CTSKCA1CA2CA7NOS1 | |
| SCHEMBL6742992 | 0.77 | CA1 (0.36) | CTSKCA1CA2CA7NOS1 |
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-0558673-A1 | RETROVIRAL PROTEASE INHIBITORS. | MONSANTO CO (US) | 1993-09-08 | — | — | EP | disclosed |
| WO-1992008699-A1 | RETROVIRAL PROTEASE INHIBITORS | MONSANTO COMPANY (US) | 1992-05-29 | — | — | WO | disclosed |