Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTK | P33981 | 1/20 | 0.40 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.40 |
| ▸ | MAP2K4 | P45985 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 10/20 | 0.39 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.39 |
| ▸ | MAPKAPK3 | Q16644 | 1/20 | 0.39 |
| ▸ | MAPK6 | Q16659 | 1/20 | 0.39 |
| ▸ | MAPKAPK5 | Q8IW41 | 1/20 | 0.39 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | JAK1 | P23458 | 1/20 | 0.36 |
| ▸ | MAPK3 | P27361 | 3/20 | 0.35 |
| ▸ | BRAF | P15056 | 1/20 | 0.35 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.35 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.35 |
| ▸ | ITGAV | P06756 | 1/20 | 0.35 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.35 |
| ▸ | ITGB6 | P18564 | 1/20 | 0.35 |
| ▸ | KDM5A | P29375 | 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 | |
|---|---|---|---|---|
| SCHEMBL8682713 | 0.71 | MAPK1 (0.42) | MAP2K4MAPK1MAPKAPK3MAPK6JAK2 | |
| SCHEMBL30620040 | 0.70 | MAP2K4 (0.46) | TTKMAPK8MAP2K4MAPK1MAPKAPK2 | |
| SCHEMBL8682718 | 0.69 | MAPK1 (0.44) | MAP2K4MAPK1MAPKAPK3MAPK6JAK2 | |
| SCHEMBL30864287 | 0.69 | LRRK2 (0.60) | TTKMAPK8MAP2K4MAPK1MAPKAPK2 | |
| SCHEMBL30620072 | 0.69 | MAP2K4 (0.44) | TTKMAPK8MAP2K4MAPK1MAPKAPK2 | |
| SCHEMBL8684065 | 0.68 | RAB9A (0.47) | MAPK1MAPK3 | |
| SCHEMBL8684069 | 0.67 | RAB9A (0.46) | MAPK1MAPK3 | |
| SCHEMBL20211319 | 0.66 | CHEK2 (0.42) | TTKMAPK8MAP2K4MAPK1MAPKAPK2 | |
| SCHEMBL4783157 | 0.65 | JAK2 (0.47) | MAPK1JAK2JAK1MAPK3 | |
| SCHEMBL6300270 | 0.65 | FABP1 (0.58) | KDM5A |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998043962-A1 | HETEROCYCLIC INTEGRIN INHIBITOR PRODRUGS | DU PONT PHARMACEUTICALS COMPANY (US) | 1998-10-08 | — | — | WO | disclosed |