Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 7/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | CEL | P19835 | 2/20 | 0.33 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.32 |
| ▸ | CASP3 | P42574 | 2/20 | 0.32 |
| ▸ | FEN1 | P39748 | 4/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.31 |
| ▸ | ALOX5AP | P20292 | 3/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28688565 | 0.77 | PARP1 (0.45) | MAOAMAOBPARP1HPGDKDM4E | |
| SCHEMBL2662415 | 0.76 | MAOA (0.43) | MAOAMAOBPARP1HPGDKDM4E | |
| SCHEMBL2653820 | 0.75 | KDM4E (0.42) | MAOAMAOBPARP1HPGDKDM4E | |
| SCHEMBL14775706 | 0.67 | PARP1 (0.44) | MAOAMAOBPARP1HPGDKDM4E | |
| SCHEMBL11519137 | 0.65 | MAOA (0.55) | MAOAMAOBHPGDKDM4EALDH1A1 | |
| SCHEMBL17327476 | 0.65 | KMO (0.37) | KDM4ECELEPHX2 | |
| SCHEMBL2951374 | 0.65 | PARP1 (0.53) | MAOAMAOBPARP1HPGDKDM4E | |
| SCHEMBL28485939 | 0.63 | PARP1 (0.44) | MAOAMAOBPARP1HPGDKDM4E | |
| SCHEMBL110591 | 0.63 | PARP1 (0.38) | PARP1HPGDKDM4EALDH1A1HSD17B10 | |
| SCHEMBL10607840 | 0.62 | PARP1 (0.53) | MAOAMAOBPARP1HPGDKDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109761943-A | A kind of synthetic method of C-3 alkyl substituted cumarin derivative | 浙江工业大学 | 2019-05-17 | — | — | CN | disclosed |