Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 8/20 | 0.54 |
| ▸ | SRC | P12931 | 5/20 | 0.54 |
| ▸ | BTK | Q06187 | 3/20 | 0.54 |
| ▸ | BLK | P51451 | 2/20 | 0.54 |
| ▸ | ITK | Q08881 | 1/20 | 0.54 |
| ▸ | MKNK2 | Q9HBH9 | 3/20 | 0.49 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.49 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | ERBB2 | P04626 | 3/20 | 0.45 |
| ▸ | FYN | P06241 | 3/20 | 0.45 |
| ▸ | BMX | P51813 | 1/20 | 0.45 |
| ▸ | JAK3 | P52333 | 1/20 | 0.45 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.45 |
| ▸ | BRAF | P15056 | 1/20 | 0.44 |
| ▸ | TNNI3K | Q59H18 | 1/20 | 0.44 |
| ▸ | VCP | P55072 | 1/20 | 0.44 |
| ▸ | CCNC | P24863 | 1/20 | 0.44 |
| ▸ | CDK8 | P49336 | 1/20 | 0.44 |
| ▸ | CSF1R | P07333 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL20150991 | 0.91 | EGFR (0.53) | EGFRSRCBTKBLKITK | |
| SCHEMBL20139048 | 0.83 | SRC (0.59) | EGFRSRCBTKBLKPIK3CD | |
| SCHEMBL20139429 | 0.82 | JAK1 (0.59) | EGFRBTKERBB2JAK3CSF1R | |
| SCHEMBL29538618 | 0.82 | JAK1 (0.59) | EGFRBTKERBB2JAK3CSF1R | |
| SCHEMBL21484334 | 0.81 | ERBB2 (0.62) | EGFRSRCERBB2JAK3 | |
| Methylpiperazine SCHEMBL4771183 | 0.80 | RIPK1 (0.49) | BTKMKNK2RIPK1BRAFTNNI3K | |
| SCHEMBL20139083 | 0.79 | EGFR (0.70) | EGFRSRCBTKPIK3CDKCNH2 | |
| SCHEMBL20138988 | 0.79 | EGFR (0.60) | EGFRBTKPIK3CDERBB2JAK3 | |
| SCHEMBL20139788 | 0.79 | PIK3CD (0.49) | EGFRSRCBTKBLKPIK3CD | |
| SCHEMBL20150686 | 0.79 | EGFR (0.50) | EGFRSRCBTKBLKITK |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018088780-A1 | NOVEL PYRROLOPYRIMIDINE DERIVATIVES AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME | DAEWOONG PHARMACEUTICAL CO., LTD. (KR) | 2018-05-17 | — | — | WO | claimed |
| WO-2018088780-A1 | NOVEL PYRROLOPYRIMIDINE DERIVATIVES AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME | DAEWOONG PHARMACEUTICAL CO., LTD. (KR) | 2018-05-17 | — | — | WO | disclosed |