Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP12 | P39900 | 2/20 | 0.47 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.44 |
| ▸ | ITGAV | P06756 | 1/20 | 0.44 |
| ▸ | WDR5 | P61964 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.39 |
| ▸ | F10 | P00742 | 3/20 | 0.38 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.38 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.38 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.38 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.38 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.38 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.38 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.38 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.38 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7781180 | 0.90 | EEF2K (0.46) | ITGB3WDR5F10ITGA2BKCNQ3 | |
| SCHEMBL7785658 | 0.89 | LMNA (0.44) | ITGB3ITGAVLMNASMN1; SMN2F10 | |
| SCHEMBL7194899 | 0.89 | ITGB3 (0.44) | ITGB3ITGAVLMNASMN1; SMN2F10 | |
| SCHEMBL7790178 | 0.88 | CTSA (0.41) | MMP12ITGB3ITGAVF10ITGA2B | |
| SCHEMBL7781206 | 0.87 | ITGB3 (0.42) | MMP12ITGB3F10ITGA2B | |
| SCHEMBL7789969 | 0.87 | CYP26A1 (0.42) | ITGB3LMNASMN1; SMN2F10ITGA2B | |
| SCHEMBL7788749 | 0.86 | ITGB3 (0.44) | ITGB3LMNASMN1; SMN2ITGA2BPRSS1 | |
| SCHEMBL7785607 | 0.84 | LMNA (0.46) | ITGB3ITGAVLMNASMN1; SMN2KAT6A | |
| SCHEMBL7786214 | 0.83 | S1PR3 (0.41) | ITGB3ITGA2B | |
| SCHEMBL7786241 | 0.82 | CTSA (0.46) | ITGB3ITGAVITGA2B |
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-1147079-A2 | BETA-PHENYLALANINE DERIVATIVES AS INTEGRIN ANTAGONISTS | Bayer Aktiengesellschaft (DE) | 2001-10-24 | — | — | EP | disclosed |
| WO-2000041469-A2 | β-PHENYLALANINE DERIVATIVES AS INTEGRIN ANTAGONISTS | BAYER AKTIENGESELLSCHAFT (DE) | 2000-07-20 | — | — | WO | disclosed |