Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA4 | P13612 | 9/20 | 0.51 |
| ▸ | ITGB1 | P05556 | 7/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | MMP9 | P14780 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.44 |
| ▸ | ITGAV | P06756 | 1/20 | 0.44 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.44 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7100747 | 1.00 | ITGA4 (0.51) | ITGA4ITGB1NPSR1MEN1KMT2A | |
| SCHEMBL7099187 | 0.95 | ITGA4 (0.49) | ITGA4ITGB1NPSR1MEN1KMT2A | |
| SCHEMBL7099189 | 0.95 | ITGA4 (0.49) | ITGA4ITGB1NPSR1MEN1KMT2A | |
| SCHEMBL7102251 | 0.92 | ITGB1 (0.46) | ITGA4ITGB1NPSR1MEN1KMT2A | |
| SCHEMBL7102248 | 0.92 | ITGB1 (0.46) | ITGA4ITGB1NPSR1MEN1KMT2A | |
| SCHEMBL7102676 | 0.92 | MEN1 (0.47) | ITGA4ITGB1NPSR1MEN1KMT2A | |
| SCHEMBL7102672 | 0.92 | MEN1 (0.47) | ITGA4ITGB1NPSR1MEN1KMT2A | |
| SCHEMBL7105474 | 0.90 | NR1H4 (0.47) | ITGA4ITGB1NPSR1MEN1KMT2A | |
| SCHEMBL7098216 | 0.90 | ITGB1 (0.47) | ITGA4ITGB1NPSR1MEN1KMT2A | |
| SCHEMBL7098218 | 0.90 | ITGB1 (0.47) | ITGA4ITGB1NPSR1MEN1KMT2A |
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-0991619-B1 | INHIBITORS OF ALPHA 4-BETA 1 MEDIATED CELL ADHESION | TANABE SEIYAKU CO (JP) | 2003-09-10 | — | — | EP | claimed |