Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN2 | P17706 | 1/20 | 0.51 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.51 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.51 |
| ▸ | WNT1 | P04628 | 1/20 | 0.47 |
| ▸ | GSK3B | P49841 | 1/20 | 0.47 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.47 |
| ▸ | ABL1 | P00519 | 2/20 | 0.45 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | ME3 | Q16798 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | RAD52 | P43351 | 1/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8143555 | 0.89 | ALDH1A1 (0.48) | WNT1GSK3BDYRK1AABL1MAPK1 | |
| SCHEMBL8140931 | 0.89 | PTPN2 (0.52) | PTPN2PTPN1PTPN6WNT1GSK3B | |
| SCHEMBL8135054 | 0.87 | LMNA (0.49) | ABL1MAPK1ALDH1A1ME3RAB9A | |
| SCHEMBL7376347 | 0.84 | ALDH1A1 (0.43) | ABL1MAPK1ALDH1A1ME3MEN1 | |
| SCHEMBL7371765 | 0.84 | ME3 (0.54) | ABL1MAPK1ALDH1A1ME3MEN1 | |
| SCHEMBL7375251 | 0.83 | PTPN2 (0.61) | PTPN2PTPN1PTPN6ABL1RIN1 | |
| Trifluoroacetic Acid SCHEMBL7376343 | 0.80 | ME3 (0.48) | ABL1MAPK1ALDH1A1ME3MEN1 | |
| Acetic Acid SCHEMBL8135057 | 0.80 | ME3 (0.52) | ABL1MAPK1ALDH1A1ME3NPC1 | |
| Acetic Acid SCHEMBL7375335 | 0.80 | ME3 (0.52) | PTPN2PTPN1PTPN6ABL1ALDH1A1 | |
| SCHEMBL8144011 | 0.80 | PTPN2 (0.62) | PTPN2PTPN1PTPN6ABL1RIN1 |
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-1140792-A1 | 3,4-DIAMINO-3-CYCLOBUTENE-1,2-DIONE DERIVATIVES WHICH INHIBIT LEUKOCYTE ADHESION MEDIATED BY VLA-4 | AMERICAN HOME PRODUCTS CORPORATION (US) | 2001-10-10 | — | — | EP | claimed |
| WO-2000035855-A1 | 3,4-DIAMINO-3-CYCLOBUTENE-1,2-DIONE DERIVATIVES WHICH INHIBIT LEUKOCYTE ADHESION MEDIATED BY VLA-4 | AMERICAN HOME PRODUCTS CORPORATION (US) | 2000-06-22 | — | — | WO | claimed |