Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKN1 | Q16512 | 3/20 | 0.65 |
| ▸ | PKN2 | Q16513 | 3/20 | 0.65 |
| ▸ | PARP1 | P09874 | 2/20 | 0.58 |
| ▸ | DHODH | Q02127 | 1/20 | 0.58 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | LDHA | P00338 | 1/20 | 0.52 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 3/20 | 0.51 |
| ▸ | PNP | P00491 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | STAT1 | P42224 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | MKNK2 | Q9HBH9 | 4/20 | 0.46 |
| ▸ | PLK4 | O00444 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6809996 | 0.85 | PKN1 (0.63) | PKN1PKN2PARP1DHODHPARP2 | |
| SCHEMBL3579908 | 0.85 | PARP1 (0.61) | PKN1PKN2PARP1DHODHPARP2 | |
| SCHEMBL6809910 | 0.84 | PKN1 (0.46) | PKN1PKN2PARP1DHODHPARP2 | |
| SCHEMBL6805010 | 0.81 | METAP2 (0.53) | PKN1PKN2PARP1DHODHPARP2 | |
| SCHEMBL3585144 | 0.80 | PARP1 (0.64) | PARP1DHODHKDM4EHPGDMAPT | |
| SCHEMBL2149454 | 0.80 | PARP1 (0.63) | PKN1PKN2PARP1DHODHPARP2 | |
| SCHEMBL6806431 | 0.80 | PKN1 (0.42) | PKN1PKN2PARP1DHODHPARP2 | |
| SCHEMBL6806962 | 0.79 | PKN1 (1.00) | PKN1PKN2PARP1DHODHPARP2 | |
| SCHEMBL29696369 | 0.79 | NPC1 (0.53) | PARP1DHODHNPC1RAB9ACSNK1D | |
| SCHEMBL29411982 | 0.79 | PKN1 (1.00) | PKN1PKN2PARP1DHODHPARP2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6696437-B1 | Heterocyclically substituted benzimidazoles, the production and application thereof | ABBOTT GMBH & CO. KG (DE) | 2004-02-24 | — | — | US | disclosed |