Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA4 | P13612 | 17/20 | 0.51 |
| ▸ | ITGB1 | P05556 | 4/20 | 0.44 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7338154 | 0.88 | PPARG (0.51) | PPARG | |
| SCHEMBL7348204 | 0.80 | ITGA4 (0.54) | ITGA4ITGB1 | |
| SCHEMBL7346029 | 0.80 | PPARG (0.49) | PPARG | |
| SCHEMBL7339686 | 0.80 | PPARG (0.49) | PPARG | |
| SCHEMBL7340357 | 0.80 | ITGA4 (0.57) | ITGA4ITGB1 | |
| SCHEMBL7340367 | 0.80 | ITGA4 (0.57) | ITGA4ITGB1 | |
| SCHEMBL7348064 | 0.80 | CTSL (0.42) | — | |
| SCHEMBL7343130 | 0.80 | CTSL (0.42) | — | |
| SCHEMBL7337043 | 0.79 | ACACB (0.43) | — | |
| SCHEMBL7340724 | 0.78 | PPARG (0.43) | PPARG |
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 |
|---|---|---|---|---|---|---|---|
| US-6423689-B1 | Peptidyl calcium channel blockers | WARNER-LAMBERT COMPANY | 2002-07-23 | — | — | US | claimed |
| US-6423689-B1 | Peptidyl calcium channel blockers | WARNER-LAMBERT COMPANY | 2002-07-23 | — | — | US | disclosed |