Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.50 |
| ▸ | XDH | P47989 | 2/20 | 0.46 |
| ▸ | MMP2 | P08253 | 4/20 | 0.45 |
| ▸ | MMP9 | P14780 | 4/20 | 0.45 |
| ▸ | MMP8 | P22894 | 4/20 | 0.45 |
| ▸ | MMP13 | P45452 | 3/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.45 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.45 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.45 |
| ▸ | TNKS | O95271 | 2/20 | 0.42 |
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.42 |
| ▸ | GUSB | P08236 | 1/20 | 0.42 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.42 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.42 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL17673804 | 0.98 | MAPT (0.51) | MAPTXDHMMP2MMP9MMP8 | |
| SCHEMBL4331798 | 0.79 | MAPT (0.54) | MAPTMMP2MMP9MMP8MMP13 | |
| SCHEMBL1417058 | 0.73 | GRK6 (0.46) | MAPTHTTNPC1RAB9AALDH1A1 | |
| SCHEMBL18023765 | 0.71 | XDH (0.51) | MAPTXDHMMP2MMP9MMP8 | |
| SCHEMBL17673753 | 0.70 | MMP2 (0.52) | MAPTXDHMMP2MMP9MMP8 | |
| SCHEMBL264644 | 0.70 | XDH (0.51) | MAPTXDHMMP2MMP9MMP8 | |
| SCHEMBL11115438 | 0.70 | CA2 (0.52) | TNKSCA12CA1CA2CA9 | |
| SCHEMBL76309 | 0.70 | NPC1 (0.55) | MAPTXDHMMP2MMP9MMP8 | |
| SCHEMBL13043220 | 0.70 | NISCH (0.48) | MAPTNPC1CASP3RAB9ASENP7 | |
| SCHEMBL3751343 | 0.70 | ASIC3 (0.44) | MAPTMMP2MMP9MMP8MMP13 |
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-105566355-A | 4-(4-nitrophenyl)-4H-1,2,4-triazole copper complex monocrystal and applications thereof | UNIV TIANJIN | 2016-05-11 | — | — | CN | claimed |
| CN-105566355-A | 4-(4-nitrophenyl)-4H-1,2,4-triazole copper complex monocrystal and applications thereof | UNIV TIANJIN | 2016-05-11 | — | — | CN | disclosed |