Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNKS2 | Q9H2K2 | 6/20 | 0.56 |
| ▸ | PARP1 | P09874 | 6/20 | 0.56 |
| ▸ | QTRT1 | Q9BXR0 | 1/20 | 0.56 |
| ▸ | TNKS | O95271 | 4/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.51 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.49 |
| ▸ | TUBB | P07437 | 1/20 | 0.49 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.49 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.49 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.49 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.49 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.49 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL31237470 | 0.82 | PARP1 (0.56) | TNKS2PARP1QTRT1TNKSKMT2A | |
| SCHEMBL10614150 | 0.78 | TNKS2 (0.64) | TNKS2PARP1QTRT1KMT2APKM | |
| SCHEMBL6695759 | 0.75 | TNKS2 (0.81) | TNKS2PARP1QTRT1TNKSPKM | |
| SCHEMBL7978349 | 0.75 | KMT2A (0.74) | TNKS2PARP1KMT2APKMPDE10A | |
| SCHEMBL15775653 | 0.74 | TNKS (0.71) | TNKS2PARP1TNKSPARP2RAB9A | |
| SCHEMBL16404338 | 0.74 | PDE10A (0.84) | TNKS2PARP1KMT2APDE10APARP2 | |
| SCHEMBL13313501 | 0.73 | PARP1 (0.60) | TNKS2PARP1TNKSHPGDKDM4E | |
| SCHEMBL31677104 | 0.73 | PSMB8 (0.58) | KMT2APKMRAB9APOLBALDH1A1 | |
| SCHEMBL244929 | 0.73 | PSMB8 (0.58) | KMT2APKMRAB9APOLBALDH1A1 | |
| SCHEMBL12946039 | 0.72 | MAPT (0.57) | TNKS2PARP1QTRT1TNKSKMT2A |
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-106008373-B | Disubstituted bicyclic derivative and its application as efflux pump inhibitor in antibacterial | 山东大学 | 2019-02-22 | — | — | CN | disclosed |