Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 2/20 | 0.60 |
| ▸ | GAA | P10253 | 1/20 | 0.59 |
| ▸ | RAB9A | P51151 | 1/20 | 0.59 |
| ▸ | LTA4H | P09960 | 1/20 | 0.55 |
| ▸ | YAP1 | P46937 | 5/20 | 0.54 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.54 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.53 |
| ▸ | LNPEP | Q9UIQ6 | 1/20 | 0.53 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | GPR132 | Q9UNW8 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | GPR34 | Q9UPC5 | 1/20 | 0.51 |
| ▸ | MMP9 | P14780 | 1/20 | 0.51 |
| ▸ | MMP8 | P22894 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL6516668 | 0.92 | PPARG (0.61) | PPARGGAAGPR132ALDH1A1GPR34 | |
| SCHEMBL1122843 | 0.85 | GAA (0.67) | PPARGGAARAB9ALTA4HYAP1 | |
| SCHEMBL1123055 | 0.85 | GAA (0.80) | PPARGGAARAB9ALTA4HYAP1 | |
| SCHEMBL1123122 | 0.85 | RAB9A (0.66) | PPARGGAARAB9ALTA4HYAP1 | |
| SCHEMBL16552342 | 0.83 | PPARG (0.69) | PPARGGAARAB9ALTA4HYAP1 | |
| SCHEMBL1122743 | 0.83 | GPR132 (0.76) | PPARGGAARAB9AYAP1ERAP2 | |
| SCHEMBL1122705 | 0.83 | GPR132 (0.76) | PPARGGAARAB9AYAP1ERAP2 | |
| SCHEMBL1122834 | 0.82 | GAA (0.75) | PPARGGAARAB9ALTA4HYAP1 | |
| SCHEMBL1122925 | 0.82 | GAA (0.75) | PPARGGAARAB9ALTA4HYAP1 | |
| SCHEMBL1122839 | 0.82 | GAA (0.68) | PPARGGAARAB9ALTA4HYAP1 |
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-1056714-B1 | PHENYLALANINE DERIVATIVES AS INHIBITORS OF ALPHA4 INTEGRINS | CELLTECH THERAPEUTICS LTD (GB) | 2004-08-11 | — | — | EP | disclosed |
| US-6555562-B1 | 2-Carboxybenzoyl-(N'-3,5-dichloroisonicotinoyl)-L-4aminophenyl alanine, for example; inhibit the binding of alpha-4 integrins to their ligands, use to treat immune or inflammatory disorders | CELLTECH R&D LIMITED (GB) | 2003-04-29 | — | — | US | disclosed |