Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGAL | P20701 | 2/20 | 0.56 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | TLR2 | O60603 | 4/20 | 0.35 |
| ▸ | TLR1 | Q15399 | 4/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | SIRT2 | Q8IXJ6 | 2/20 | 0.34 |
| ▸ | SIRT1 | Q96EB6 | 2/20 | 0.34 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | CTSL | P07711 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1777643 | 1.00 | ITGAL (0.56) | ITGALLMNAMEN1ALDH1A1KMT2A | |
| SCHEMBL1777642 | 1.00 | ITGAL (0.56) | ITGALLMNAMEN1ALDH1A1KMT2A | |
| SCHEMBL4638326 | 0.94 | ITGAL (0.63) | ITGALALDH1A1KDM4ECYP3A4MAPT | |
| SCHEMBL1777467 | 0.94 | ITGAL (0.63) | ITGALALDH1A1KDM4ECYP3A4MAPT | |
| SCHEMBL1777466 | 0.94 | ITGAL (0.63) | ITGALALDH1A1KDM4ECYP3A4MAPT | |
| SCHEMBL1777058 | 0.94 | ITGAL (0.64) | ITGALLMNAALDH1A1KDM4ECYP3A4 | |
| SCHEMBL1777060 | 0.94 | ITGAL (0.64) | ITGALLMNAALDH1A1KDM4ECYP3A4 | |
| SCHEMBL4637570 | 0.94 | ITGAL (0.64) | ITGALLMNAALDH1A1KDM4ECYP3A4 | |
| SCHEMBL10063807 | 0.92 | ITGAL (0.57) | ITGALGAA | |
| SCHEMBL4639099 | 0.91 | ITGAL (0.67) | ITGALALDH1A1CYP3A4GAACTSL |
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-1951665-A1 | NOVEL INHIBITORS OF THE LFA-1/ICAM-1 INTERACTION, AND USES THEREOF | Dominion Pharmakine S.L. (ES) | 2008-08-06 | — | — | EP | disclosed |
| WO-2007054128-A1 | NOVEL INHIBITORS OF THE LFA-1/ICAM-1 INTERACTION, AND USES THEREOF | DOMINION PHARMAKINE S.L. (ES) | 2007-05-18 | — | — | WO | disclosed |