Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA4 | P13612 | 1/20 | 0.73 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.73 |
| ▸ | GAA | P10253 | 1/20 | 0.73 |
| ▸ | MEN1 | O00255 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | NPC1 | O15118 | 1/20 | 0.57 |
| ▸ | RAB9A | P51151 | 1/20 | 0.57 |
| ▸ | ATM | Q13315 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.51 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.51 |
| ▸ | FPR2 | P25090 | 1/20 | 0.51 |
| ▸ | BCHE | P06276 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | BACE1 | P56817 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL6375429 | 1.00 | ITGA4 (0.73) | ITGA4ITGB7ALDH1A1GAAMEN1 | |
| SCHEMBL3857463 | 0.86 | ITGA4 (0.57) | ITGA4ITGB7ALDH1A1GAAMEN1 | |
| SCHEMBL3857454 | 0.86 | ITGA4 (0.57) | ITGA4ITGB7ALDH1A1GAAMEN1 | |
| SCHEMBL30340352 | 0.86 | PDCD1 (0.61) | ITGA4ITGB7ALDH1A1GAAMEN1 | |
| SCHEMBL7390734 | 0.84 | ALDH1A1 (0.67) | ITGA4ITGB7ALDH1A1GAAMEN1 | |
| SCHEMBL5215651 | 0.84 | ALDH1A1 (0.67) | ITGA4ITGB7ALDH1A1GAAMEN1 | |
| SCHEMBL5215743 | 0.80 | ALDH1A1 (0.61) | ITGA4ITGB7ALDH1A1GAAMEN1 | |
| SCHEMBL2247336 | 0.80 | ITGA4 (0.53) | ITGA4ITGB7ALDH1A1GAAMEN1 | |
| SCHEMBL28047718 | 0.80 | PTPN1 (0.61) | ITGA4ITGB7ALDH1A1GAAKMT2A | |
| SCHEMBL28047720 | 0.80 | PTPN1 (0.61) | ITGA4ITGB7ALDH1A1GAAKMT2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1001764-A4 | HETEROCYCLIC AMIDE COMPOUNDS AS CELL ADHESION INHIBITORS | MERCK & CO INC (US) | 2005-08-24 | — | — | EP | disclosed |
| US-6903075-B1 | Heterocyclic amide compounds as cell adhesion inhibitors | MERCK & CO., INC. (US) | 2005-06-07 | — | — | US | disclosed |
| EP-1001764-A1 | HETEROCYCLIC AMIDE COMPOUNDS AS CELL ADHESION INHIBITORS | Merck & Co., Inc. (a New Jersey corp.) (US) | 2000-05-24 | — | — | EP | disclosed |
| WO-1999064395-A1 | HETEROCYCLIC AMIDE COMPOUNDS AS CELL ADHESION INHIBITORS | MERCK & CO., INC. (US) | 1999-12-16 | — | — | WO | disclosed |
| WO-1998053814-A1 | HETEROCYCLIC AMIDE COMPOUNDS AS CELL ADHESION INHIBITORS | MERCK & CO., INC. (US) | 1998-12-03 | — | — | WO | disclosed |