Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCL9 | O00512 | 7/20 | 0.47 |
| ▸ | CTNNB1 | P35222 | 7/20 | 0.47 |
| ▸ | JAK2 | O60674 | 2/20 | 0.47 |
| ▸ | JAK1 | P23458 | 2/20 | 0.47 |
| ▸ | TYK2 | P29597 | 2/20 | 0.47 |
| ▸ | JAK3 | P52333 | 2/20 | 0.47 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.44 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | CTSL | P07711 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5140956 | 1.00 | BCL9 (0.47) | BCL9CTNNB1JAK2JAK1TYK2 | |
| SCHEMBL14312873 | 0.91 | PDE4B (0.47) | JAK2JAK1PDE4BSMN1; SMN2NPC1 | |
| SCHEMBL14313170 | 0.81 | BCL9 (0.44) | BCL9CTNNB1JAK2JAK1TYK2 | |
| SCHEMBL26602429 | 0.79 | USP30 (0.53) | BCL9CTNNB1JAK2JAK1TYK2 | |
| SCHEMBL2063481 | 0.79 | USP30 (0.58) | ITGB3ITGA2BPDE4BSMN1; SMN2NPC1 | |
| SCHEMBL2063483 | 0.79 | USP30 (0.58) | ITGB3ITGA2BPDE4BSMN1; SMN2NPC1 | |
| SCHEMBL6128873 | 0.79 | USP30 (0.58) | ITGB3ITGA2BPDE4BSMN1; SMN2NPC1 | |
| SCHEMBL15669949 | 0.79 | USP30 (0.53) | BCL9CTNNB1JAK2JAK1TYK2 | |
| SCHEMBL14514789 | 0.78 | ACKR3 (0.56) | ITGB3ITGA2BPDE4BSMN1; SMN2NPC1 | |
| SCHEMBL14145058 | 0.77 | PDE4B (0.54) | BCL9CTNNB1JAK2JAK1TYK2 |
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-1945222-A2 | PYRROLO[2,1-F] [1,2,4] TRIAZIN-4-YLAMINES IGF-1R KINASE INHIBITORS FOR THE TREATMENT OF CANCER AND OTHER HYPERPROLIFERATIVE DISEASES | Bayer HealthCare AG (DE) | 2008-07-23 | — | — | EP | disclosed |
| WO-2007056170-A2 | PYRROLO[2,1-F] [1,2,4] TRIAZIN-4-YLAMINES IGF-1R KINASE INHIBITORS FOR THE TREATMENT OF CANCER AND OTHER HYPERPROLIFERATIVE DISEASES | BAYER HEALTHCARE AG (DE) | 2007-05-18 | — | — | WO | disclosed |