Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 1/20 | 0.44 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.41 |
| ▸ | PRKDC | P78527 | 3/20 | 0.40 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.40 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.40 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.40 |
| ▸ | ITGAL | P20701 | 2/20 | 0.39 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.39 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA6 | P23280 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6198216 | 0.88 | KMO (0.39) | KMOAKR1C3PRKDCPIK3CDPIK3CA | |
| SCHEMBL6197601 | 0.86 | ITGAL (0.44) | KMOAKR1C3ITGALITGB2ICAM1 | |
| SCHEMBL6311315 | 0.84 | ITGAL (0.42) | KMOAKR1C3ITGALITGB2ICAM1 | |
| SCHEMBL6318224 | 0.81 | NOTUM (0.42) | AKR1C3ITGALITGB2ICAM1MAPT | |
| SCHEMBL6317504 | 0.80 | LGMN (0.44) | ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL6201628 | 0.79 | LGMN (0.47) | ITGALITGB2ICAM1ALDH1A1CYP2C19 | |
| SCHEMBL6318620 | 0.79 | ITGAL (0.43) | AKR1C3ITGALITGB2ICAM1CA12 | |
| SCHEMBL6317609 | 0.78 | ITGAL (0.43) | AKR1C3ITGALITGB2ICAM1CA12 | |
| SCHEMBL6308942 | 0.77 | NOTUM (0.43) | AKR1C3ITGALITGB2ICAM1ALDH1A1 | |
| SCHEMBL6316869 | 0.76 | PNP (0.34) | CA12CA2CA4CA6CA7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1140814-B1 | CELL ADHESION-INHIBITING ANTIINFLAMMATORY AND IMMUNE-SUPPRESSIVE COMPOUNDS | ABBOTT LAB (US) | 2005-05-25 | — | — | EP | disclosed |