Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | POLB | P06746 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.41 |
| ▸ | CLK1 | P49759 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | ITGB2 | P05107 | 2/20 | 0.37 |
| ▸ | ICAM1 | P05362 | 2/20 | 0.37 |
| ▸ | ITGAL | P20701 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6218325 | 0.96 | NPC1 (0.46) | NPC1RAB9APOLBKDM4ECLK1 | |
| SCHEMBL6218470 | 0.89 | ITGAL (0.41) | KDM4EALDH1A1SMN1; SMN2ITGB2ICAM1 | |
| SCHEMBL6222534 | 0.86 | ITGAL (0.46) | KDM4EALDH1A1SMN1; SMN2ITGB2ICAM1 | |
| SCHEMBL6220749 | 0.86 | HTT (0.51) | NPC1RAB9APOLBKDM4ECLK1 | |
| SCHEMBL6220061 | 0.85 | ENPP2 (0.36) | NPC1RAB9APOLBKDM4ECLK1 | |
| SCHEMBL6198120 | 0.85 | ITGB2 (0.48) | NPC1RAB9APOLBKDM4ECLK1 | |
| SCHEMBL6219394 | 0.85 | ITGAL (0.37) | NPC1RAB9APOLBRXFP1ALDH1A1 | |
| SCHEMBL6247234 | 0.84 | ITGB2 (0.35) | NPC1RAB9APOLBSMN1; SMN2ITGB2 | |
| SCHEMBL6217836 | 0.83 | ALDH1A1 (0.53) | NPC1RAB9APOLBKDM4ECLK1 | |
| SCHEMBL6218779 | 0.82 | NPC1 (0.45) | NPC1RAB9APOLBKDM4ECLK1 |
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 | claimed |