Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 3/20 | 0.48 |
| ▸ | BTK | Q06187 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.47 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.47 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | PLCG1 | P19174 | 1/20 | 0.44 |
| ▸ | CASR | P41180 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28424597 | 1.00 | EGFR (0.48) | EGFRBTKLMNACD274PRMT5 | |
| SCHEMBL21282757 | 0.83 | EGFR (0.51) | EGFRBTKLMNAERBB2ALDH1A1 | |
| SCHEMBL28424241 | 0.83 | EGFR (0.51) | EGFRBTKLMNAERBB2ALDH1A1 | |
| SCHEMBL21282754 | 0.81 | HDAC3 (0.53) | LMNAPRMT5WDR77HDAC3HDAC1 | |
| SCHEMBL28421495 | 0.81 | HDAC3 (0.53) | LMNAPRMT5WDR77HDAC3HDAC1 | |
| SCHEMBL21282758 | 0.81 | CDK14 (0.57) | BTKHDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL28421375 | 0.81 | CDK14 (0.57) | BTKHDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL6814510 | 0.74 | KDR (0.62) | LMNACD274ALDH1A1SMN1; SMN2KMT2A | |
| SCHEMBL31396764 | 0.73 | KMT2A (0.59) | LMNAPRMT5WDR77HDAC3HDAC1 | |
| SCHEMBL10130045 | 0.72 | MAPK14 (0.60) | EGFRMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111247137-A | Pyrimidine compound, preparation method and medical application thereof | 恩瑞生物医药科技（上海）有限公司 | 2020-06-05 | — | — | CN | disclosed |
| WO-2019157959-A1 | PYRIMIDINE COMPOUND, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF | 恩瑞生物医药科技（上海）有限公司 | 2019-08-22 | — | — | WO | disclosed |