Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 1/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
| ▸ | MMP8 | P22894 | 1/20 | 0.43 |
| ▸ | MMP13 | P45452 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 5/20 | 0.43 |
| ▸ | DHODH | Q02127 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.41 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | USP2 | O75604 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27763520 | 0.90 | DHODH (0.48) | ADORA3PARP1DHODHPKN1PKN2 | |
| SCHEMBL27742871 | 0.90 | DHODH (0.44) | PARP1DHODHNPC1RAB9APKN1 | |
| SCHEMBL27763508 | 0.88 | MMP2 (0.44) | MMP2MMP9MMP8MMP13ADORA3 | |
| SCHEMBL27742892 | 0.88 | MMP2 (0.43) | MMP2MMP9MMP8MMP13ADORA3 | |
| SCHEMBL27763517 | 0.88 | DHODH (0.45) | MMP2MMP9MMP8MMP13ADORA3 | |
| SCHEMBL28780427 | 0.86 | PARP1 (0.51) | MMP2MMP9MMP8MMP13PARP1 | |
| SCHEMBL27742890 | 0.85 | MAPT (0.49) | PARP1DHODHNPC1RAB9APKN1 | |
| SCHEMBL27742889 | 0.84 | DHODH (0.46) | PARP1DHODHPKN1PKN2MAPT | |
| SCHEMBL27742878 | 0.82 | PARP1 (0.48) | PARP1DHODHNPC1RAB9APKN1 | |
| SCHEMBL27742898 | 0.82 | MAPT (0.49) | ADORA3PARP1DHODHNPC1RAB9A |
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-101434601-A | 2-furyl-1H-benzimidazole-4-acidamide type derivative | UNIV SHANGHAI JIAOTONG (CN) | 2009-05-20 | — | — | CN | disclosed |