Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IGF1R | P08069 | 2/20 | 0.45 |
| ▸ | BTK | Q06187 | 2/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | USP30 | Q70CQ3 | 4/20 | 0.43 |
| ▸ | PIM1 | P11309 | 2/20 | 0.43 |
| ▸ | PIM2 | Q9P1W9 | 2/20 | 0.43 |
| ▸ | JAK1 | P23458 | 1/20 | 0.43 |
| ▸ | TYK2 | P29597 | 1/20 | 0.43 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | FPR3 | P25089 | 1/20 | 0.42 |
| ▸ | FPR2 | P25090 | 1/20 | 0.42 |
| ▸ | PBK | Q96KB5 | 1/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20154984 | 1.00 | IGF1R (0.45) | IGF1RBTKPARP1USP30PIM1 | |
| SCHEMBL20154901 | 1.00 | IGF1R (0.45) | IGF1RBTKPARP1USP30PIM1 | |
| SCHEMBL20155254 | 0.88 | IGF1R (0.45) | IGF1RBTKPARP1USP30PIM1 | |
| SCHEMBL6523004 | 0.88 | IGF1R (0.45) | IGF1RBTKPARP1USP30PIM1 | |
| SCHEMBL6523000 | 0.88 | IGF1R (0.45) | IGF1RBTKPARP1USP30PIM1 | |
| SCHEMBL20154982 | 0.88 | ALDH1A1 (0.49) | BTKJAK1TYK2PIK3CA | |
| SCHEMBL29072509 | 0.86 | MAPK3 (0.49) | BTKPARP1USP30PIM1PIM2 | |
| SCHEMBL29072837 | 0.86 | MAPK3 (0.49) | BTKPARP1USP30PIM1PIM2 | |
| SCHEMBL29072510 | 0.86 | MAPK3 (0.49) | BTKPARP1USP30PIM1PIM2 | |
| SCHEMBL30841573 | 0.85 | BTK (0.49) | IGF1RBTKPARP1USP30PIM1 |
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-2018086547-A1 | 2-SUBSTITUTED AROMATIC RING-PYRIMIDINE DERIVATIVE, AND PREPARATION AND APPLICATION THEREOF | 浙江大学 | 2018-05-17 | — | — | WO | disclosed |