Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIP4K2C | Q8TBX8 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 5/20 | 0.40 |
| ▸ | ACHE | P22303 | 5/20 | 0.40 |
| ▸ | APP | P05067 | 3/20 | 0.36 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.33 |
| ▸ | CCNE1 | P24864 | 4/20 | 0.32 |
| ▸ | CDK2 | P24941 | 4/20 | 0.32 |
| ▸ | JAK3 | P52333 | 1/20 | 0.31 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.31 |
| ▸ | TRIM58 | Q8NG06 | 1/20 | 0.31 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.31 |
| ▸ | CDK9 | P50750 | 1/20 | 0.31 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19929876 | 0.89 | BCHE (0.41) | PIP4K2CBCHEACHEAPPCXCR2 | |
| SCHEMBL19930112 | 0.82 | ALK (0.38) | PIP4K2CBCHEACHEAPPCXCR2 | |
| SCHEMBL19929868 | 0.74 | JAK2 (0.43) | PIP4K2CBCHEACHEAPPCTNNB1 | |
| SCHEMBL19929908 | 0.72 | ALK (0.36) | BCHEACHEAPPADRA1DADRA1A | |
| SCHEMBL24018766 | 0.67 | IFNAR1 (0.51) | ADRA2AADRA2BADRA2CADRA1DADRA1A | |
| SCHEMBL28164308 | 0.65 | POLB (0.36) | — | |
| SCHEMBL19929901 | 0.65 | BCHE (0.41) | PIP4K2CBCHEACHEAPPCDK2 | |
| SCHEMBL19929855 | 0.64 | ALK (0.38) | PIP4K2CBCHEACHEJAK3TRIM58 | |
| SCHEMBL19929854 | 0.64 | ALK (0.37) | BCHEACHEAPPJAK3TRIM58 | |
| SCHEMBL19930114 | 0.63 | ALK (0.46) | ADRA1AJAK3CDK9 |
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-3290420-B1 | PYRIMIDINE PYRROLE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION, AND USES THEREOF | UNIV XIAMEN (CN) | 2020-12-09 | — | — | EP | disclosed |
| EP-3290420-A1 | PYRIMIDINE PYRROLE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION, AND USES THEREOF | Xiamen University (CN) | 2018-03-07 | — | — | EP | disclosed |