Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 6/20 | 0.44 |
| ▸ | BRAF | P15056 | 1/20 | 0.39 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
| ▸ | JAK3 | P52333 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 2/20 | 0.37 |
| ▸ | TDO2 | P48775 | 2/20 | 0.37 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.36 |
| ▸ | TUBB | P07437 | 2/20 | 0.36 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.36 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.36 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.36 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.36 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.36 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.36 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.36 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.36 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.36 |
| ▸ | TUBA1C | Q9BQE3 | 2/20 | 0.36 |
| ▸ | TUBB6 | Q9BUF5 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28341117 | 0.88 | P2RX7 (0.47) | P2RX7BRAFJAK2JAK3IDO1 | |
| Ethoxycarbonyl Group SCHEMBL28880744 | 0.86 | JAK2 (0.48) | BRAFJAK2JAK3PTGS2IDO1 | |
| Ethoxycarbonyl Group SCHEMBL28341236 | 0.78 | JAK2 (0.39) | JAK2TUBB4ATUBBTUBA3CTUBA1B | |
| Ethoxycarbonyl Group SCHEMBL27908786 | 0.78 | TUBB1 (0.41) | TUBB4ATUBBTUBA3CTUBA1BTUBA4A | |
| Ethoxycarbonyl Group SCHEMBL28341459 | 0.78 | TUBB4A (0.39) | TUBB4ATUBBTUBA3CTUBA1BTUBA4A | |
| Ethoxycarbonyl Group SCHEMBL28338823 | 0.78 | P2RX7 (0.40) | P2RX7IDO1TDO2 | |
| Ethoxycarbonyl Group SCHEMBL28844709 | 0.77 | P2RX7 (0.47) | P2RX7IDO1TDO2 | |
| SCHEMBL28338777 | 0.75 | IDO1 (0.43) | PTGS2IDO1TDO2TUBB4ATUBB | |
| Ethoxycarbonyl Group SCHEMBL27551543 | 0.74 | NR3C1 (0.35) | P2RX7 | |
| Ethoxycarbonyl Group SCHEMBL28291587 | 0.71 | ALDH1A1 (0.40) | IDO1TUBB4ATUBBTUBA3CTUBA1B |
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-110483366-A | Benzazole compounds and preparation method thereof, pharmaceutical composition and purposes | INST MATERIA MEDICA CAMS | 2019-11-22 | — | — | CN | disclosed |