Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | ITGAL | P20701 | 5/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.36 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.36 |
| ▸ | CYP21A2 | P08686 | 1/20 | 0.36 |
| ▸ | FPR1 | P21462 | 1/20 | 0.36 |
| ▸ | FPR2 | P25090 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.35 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.35 |
| ▸ | CCR1 | P32246 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7665393 | 0.82 | ITGAL (0.41) | ITGALITGB2ICAM1 | |
| SCHEMBL7665397 | 0.82 | ITGAL (0.41) | ITGALITGB2ICAM1 | |
| SCHEMBL7663043 | 0.80 | ITGAL (0.46) | ITGALITGB2ICAM1 | |
| SCHEMBL4848485 | 0.70 | MCHR1 (0.40) | MCHR1CYP3A4ITGALCYP11B1CYP11B2 | |
| SCHEMBL14526280 | 0.66 | GRM2 (0.38) | MCHR1CYP3A4ITGALCYP11B1CYP11B2 | |
| SCHEMBL3839434 | 0.65 | ITGAL (0.52) | ITGALITGB2ICAM1 | |
| SCHEMBL3839432 | 0.65 | ITGAL (0.52) | ITGALITGB2ICAM1 | |
| SCHEMBL13823906 | 0.65 | ITGB2 (0.48) | MCHR1ITGALCYP11B1CYP11B2ITGB2 | |
| SCHEMBL13817292 | 0.64 | ITGB2 (0.70) | ITGALITGB2ICAM1 | |
| SCHEMBL3838174 | 0.64 | ITGAL (0.68) | ITGALITGB2ICAM1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6365615-B1 | DICHLOROPHENYL TETRAHYDROPYRROLO(1,2-C)IMIDAZOLE-1,3-DIONES; IMMUNE CELL MEDIATED CONDITIONS; ANTAGONISTS OF THE BINDING OF HUMON INTERCELLULAR ADHESION MOLECULES | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. | 2002-04-02 | — | — | US | claimed |
| WO-2001007052-A1 | SMALL MOLECULES USEFUL IN THE TREATMENT OF INFLAMMATORY DISEASE | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 2001-02-01 | — | — | WO | claimed |
| US-6365615-B1 | DICHLOROPHENYL TETRAHYDROPYRROLO(1,2-C)IMIDAZOLE-1,3-DIONES; IMMUNE CELL MEDIATED CONDITIONS; ANTAGONISTS OF THE BINDING OF HUMON INTERCELLULAR ADHESION MOLECULES | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. | 2002-04-02 | — | — | US | disclosed |