Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 1/20 | 0.63 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.63 |
| ▸ | CA2 | P00918 | 8/20 | 0.62 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.58 |
| ▸ | CA1 | P00915 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | USP30 | Q70CQ3 | 4/20 | 0.49 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.48 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.48 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.48 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7407776 | 0.86 | ITGB1 (0.81) | ITGB1ITGA4CA2CXCR4CA1 | |
| SCHEMBL16404773 | 0.80 | HDAC6 (0.67) | CXCR4ALDH1A1GRIN1GRIN2AGRIN2B | |
| SCHEMBL2975809 | 0.77 | CA2 (0.70) | CA2CA1ALDH1A1USP30 | |
| SCHEMBL21274423 | 0.77 | CA2 (0.70) | CA2CA1ALDH1A1USP30 | |
| SCHEMBL2975807 | 0.77 | PTPN1 (0.70) | CA2CA1ALDH1A1 | |
| SCHEMBL2975803 | 0.77 | PTPN1 (0.70) | CA2CA1ALDH1A1 | |
| SCHEMBL7453849 | 0.76 | CTSB (0.48) | CA2ALDH1A1 | |
| SCHEMBL7414198 | 0.76 | ITGB1 (0.81) | ITGB1ITGA4CA2CA1ALDH1A1 | |
| SCHEMBL11950580 | 0.74 | POLB (0.65) | ALDH1A1 | |
| SCHEMBL11952565 | 0.74 | POLB (0.65) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1999026923-A1 | PARA-AMINOMETHYLARYL CARBOXAMIDE DERIVATIVES | MERCK & CO., INC. (US) | 1999-06-03 | — | — | WO | disclosed |