Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA4 | P13612 | 2/20 | 0.50 |
| ▸ | ITGB7 | P26010 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 6/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.44 |
| ▸ | POLB | P06746 | 3/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.44 |
| ▸ | REN | P00797 | 2/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | MMP3 | P08254 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 1/20 | 0.42 |
| ▸ | CTSS | P25774 | 2/20 | 0.42 |
| ▸ | CTSL | P07711 | 1/20 | 0.42 |
| ▸ | CTSB | P07858 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8861647 | 0.87 | HRH4 (0.42) | ITGA4ITGB7ALDH1A1ACE | |
| SCHEMBL9069634 | 0.79 | ITGA4 (0.58) | ITGA4ITGB7MAPTTDP1POLB | |
| SCHEMBL8861579 | 0.79 | ITGA4 (0.58) | ITGA4ITGB7MAPTTDP1POLB | |
| SCHEMBL9069632 | 0.79 | ITGA4 (0.58) | ITGA4ITGB7MAPTTDP1POLB | |
| SCHEMBL7432107 | 0.79 | ITGA4 (0.51) | ITGA4ITGB7MAPTTDP1POLB | |
| SCHEMBL7432101 | 0.79 | ITGA4 (0.51) | ITGA4ITGB7MAPTTDP1POLB | |
| SCHEMBL8861597 | 0.78 | TAS1R3 (0.41) | ITGA4ITGB7CTSKACE | |
| SCHEMBL23999577 | 0.77 | ITGA4 (0.58) | ITGA4ITGB7MAPTTDP1POLB | |
| SCHEMBL23901563 | 0.77 | ITGA4 (0.58) | ITGA4ITGB7MAPTTDP1POLB | |
| SCHEMBL6428127 | 0.74 | ITGA4 (0.62) | ITGA4ITGB7MAPTTDP1POLB |
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-5599951-A | ENZYME INHIBITORS | SOCIETE CIVILE BIOPROJET (FR) | 1997-02-04 | — | — | US | disclosed |