Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 13/20 | 0.53 |
| ▸ | TEK | Q02763 | 10/20 | 0.53 |
| ▸ | LCK | P06239 | 8/20 | 0.53 |
| ▸ | SRC | P12931 | 6/20 | 0.53 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.44 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.44 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.44 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.44 |
| ▸ | PRKDC | P78527 | 1/20 | 0.44 |
| ▸ | RET | P07949 | 3/20 | 0.44 |
| ▸ | FLT3 | P36888 | 1/20 | 0.42 |
| ▸ | ABL1 | P00519 | 2/20 | 0.41 |
| ▸ | EGFR | P00533 | 2/20 | 0.41 |
| ▸ | ABL2 | P42684 | 1/20 | 0.41 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.40 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | FYN | P06241 | 1/20 | 0.40 |
| ▸ | YES1 | P07947 | 1/20 | 0.40 |
| ▸ | LYN | P07948 | 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 | |
|---|---|---|---|---|
| SCHEMBL13020100 | 0.81 | KDR (0.68) | KDRTEKLCKSRCPIK3CD | |
| SCHEMBL20162806 | 0.77 | KDR (0.58) | KDRTEKLCKSRCPIK3CD | |
| SCHEMBL30037235 | 0.77 | KDR (0.58) | KDRTEKLCKSRCPIK3CD | |
| SCHEMBL13020096 | 0.72 | SRC (0.69) | KDRTEKLCKSRCFLT3 | |
| SCHEMBL20162651 | 0.72 | KDR (0.46) | KDRTEKLCKSRCPIK3CD | |
| SCHEMBL30037546 | 0.72 | KDR (0.46) | KDRTEKLCKSRCPIK3CD | |
| SCHEMBL30538106 | 0.72 | KDR (0.46) | KDRTEKLCKSRCPIK3CD | |
| SCHEMBL20162649 | 0.72 | KDR (0.46) | KDRTEKLCKSRCPIK3CD | |
| SCHEMBL7007567 | 0.71 | KDR (0.71) | KDRTEKLCKSRCPIK3CD | |
| SCHEMBL20162934 | 0.71 | PIK3CD (0.46) | KDRTEKLCKSRCPIK3CD |
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-3541390-A1 | PYRROLOPYRIMIDINES AS CFTR POTENTIATORS | Cystic Fibrosis Foundation Therapeutics Inc. (US) | 2019-09-25 | — | — | EP | disclosed |
| WO-2018094137-A1 | PYRROLOPYRIMIDINES AS CFTR POTENTIATORS | CYSTIC FIBROSIS FOUNDATION THERAPEUTICS INC. (US) | 2018-05-24 | — | — | WO | disclosed |