Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.33 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.32 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.32 |
| ▸ | PPARG | P37231 | 3/20 | 0.32 |
| ▸ | PPARA | Q07869 | 2/20 | 0.32 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.31 |
| ▸ | RIPK3 | Q9Y572 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | POLQ | O75417 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6037550 | 0.80 | MTNR1A (0.50) | MTNR1AMTNR1BLMNAPOLBALDH1A1 | |
| SCHEMBL5152274 | 0.74 | GAA (0.45) | LMNAALDH1A1 | |
| SCHEMBL5331837 | 0.74 | LMNA (0.42) | LMNAPOLBALDH1A1POLQ | |
| SCHEMBL5155096 | 0.72 | POLB (0.55) | LMNAPOLBITGB1ITGA4ALDH1A1 | |
| SCHEMBL5281926 | 0.71 | MTNR1A (0.49) | MTNR1AMTNR1BLMNAPOLBALDH1A1 | |
| SCHEMBL6964628 | 0.69 | GAA (0.46) | LMNAPOLBALDH1A1 | |
| SCHEMBL2432439 | 0.69 | ALDH1A1 (0.45) | MTNR1AMTNR1BPPARGRIPK1RIPK3 | |
| SCHEMBL27478926 | 0.68 | TRPM8 (0.38) | LMNAALDH1A1TP53 | |
| SCHEMBL20566969 | 0.68 | IDO1 (0.50) | MTNR1AMTNR1BLMNAPPARGPPARA | |
| SCHEMBL17102979 | 0.67 | LMNA (0.37) | LMNAALDH1A1POLQ |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1189612-A4 | VLA-4 INHIBITOR COMPOUNDS | DAIICHI SEIYAKU CO (JP) | 2005-02-16 | — | — | EP | disclosed |
| EP-1189612-A1 | VLA-4 INHIBITOR COMPOUNDS | Daiichi Pharmaceutical Co., Ltd. (JP) | 2002-03-27 | — | — | EP | disclosed |
| WO-2001000206-A1 | VLA-4 INHIBITOR COMPOUNDS | DAIICHI PHARMACEUTICAL CO., LTD. (JP) | 2001-01-04 | — | — | WO | disclosed |