Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 3/20 | 0.48 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | DHODH | Q02127 | 1/20 | 0.41 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.40 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.40 |
| ▸ | TUBB | P07437 | 2/20 | 0.40 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.40 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.40 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.40 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.40 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.40 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.40 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.40 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.40 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.40 |
| ▸ | TUBA1C | Q9BQE3 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28116288 | 0.89 | PARP1 (0.53) | PARP1CHEK2MAPTTP53DHODH | |
| SCHEMBL28116664 | 0.76 | MAPT (0.52) | MAPTSMN1; SMN2TP53TUBB4ATUBB | |
| SCHEMBL16638382 | 0.72 | DHODH (0.70) | PARP1MAPTSMN1; SMN2DHODHKDM4E | |
| SCHEMBL4740751 | 0.71 | GUSB (0.59) | PARP1DHODHKDM4EALDH1A1 | |
| SCHEMBL28116663 | 0.70 | KDM4E (0.47) | PARP1MAPTSMN1; SMN2TP53DHODH | |
| Hydrochloric Acid SCHEMBL28121180 | 0.69 | ALDH1A1 (0.50) | PARP1CHEK2MAPTSMN1; SMN2DHODH | |
| SCHEMBL28116286 | 0.68 | MAPT (0.43) | PARP1CHEK2MAPTSMN1; SMN2TP53 | |
| SCHEMBL17251750 | 0.68 | MAPT (0.50) | MAPTSMN1; SMN2TP53KDM4EMEN1 | |
| SCHEMBL9628988 | 0.68 | MAPT (0.54) | MAPTSMN1; SMN2TP53NR1H4KDM4E | |
| SCHEMBL28116302 | 0.68 | CHEK2 (0.42) | PARP1CHEK2MAPTSMN1; SMN2TP53 |
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-104072425-B | Benzimidazole compound and application thereof | 大连理工大学 | 2016-12-07 | — | — | CN | disclosed |