Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 6/20 | 0.54 |
| ▸ | MEN1 | O00255 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
| ▸ | PIM1 | P11309 | 1/20 | 0.37 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL18194322 | 0.85 | ALDH1A1 (0.48) | KMT2AMEN1ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL19929858 | 0.78 | KDM4E (0.48) | KMT2AMEN1ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL20547122 | 0.78 | PTK2 (0.43) | KMT2ASLC6A3CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL19929871 | 0.77 | MAPT (0.42) | KMT2AMEN1ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL19921170 | 0.75 | EGFR (0.55) | — | |
| SCHEMBL10338670 | 0.72 | KMT2A (0.73) | KMT2AMEN1ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL2441955 | 0.70 | SLC6A3 (0.65) | KMT2AMEN1ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL4318924 | 0.69 | ALDH1A1 (0.69) | KMT2AMEN1ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL19929856 | 0.68 | MAPK1 (0.54) | KMT2AMEN1ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL19867929 | 0.67 | CDK8 (0.52) | KMT2AMEN1ALDH1A1SMN1; SMN2 |
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 |