Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 7/20 | 0.50 |
| ▸ | DHODH | Q02127 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | PIM1 | P11309 | 1/20 | 0.41 |
| ▸ | FLT3 | P36888 | 1/20 | 0.41 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.41 |
| ▸ | BRSK1 | Q8TDC3 | 1/20 | 0.41 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.41 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.41 |
| ▸ | GNRHR | P30968 | 5/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | HTR1D | P28221 | 1/20 | 0.39 |
| ▸ | HTR1B | P28222 | 1/20 | 0.39 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.39 |
| ▸ | WNT1 | P04628 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 2/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6583586 | 0.99 | PARP1 (0.51) | PARP1DHODHKDM4ESMN1; SMN2PIM1 | |
| SCHEMBL6590117 | 0.96 | PARP1 (0.51) | PARP1DHODHKDM4EPIM1FLT3 | |
| SCHEMBL6589815 | 0.95 | PARP1 (0.52) | PARP1DHODHKDM4EPIM1FLT3 | |
| SCHEMBL6583719 | 0.93 | PARP1 (0.43) | PARP1DHODHKDM4EPIM1PIM3 | |
| SCHEMBL7534102 | 0.93 | PARP1 (0.43) | PARP1DHODHKDM4EPIM1FLT3 | |
| SCHEMBL6584782 | 0.90 | AURKA (0.46) | PARP1DHODHKDM4EAURKBGNRHR | |
| SCHEMBL6587697 | 0.89 | AURKB (0.44) | PARP1DHODHKDM4EPIM1PIM3 | |
| SCHEMBL6587227 | 0.89 | PARP1 (0.44) | PARP1DHODHKDM4EPIM1FLT3 | |
| SCHEMBL6806298 | 0.88 | PARP1 (0.65) | PARP1DHODHPIM1FLT3PIM3 | |
| SCHEMBL6810652 | 0.88 | PARP1 (0.66) | PARP1DHODHPIM1FLT3PIM3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1177178-B1 | HETEROCYCLICALLY SUBSTITUTED BENZIMIDAZOLES, THE PRODUCTION AND APPLICATION THEREOF | ABBOTT GMBH & CO KG (DE) | 2004-12-29 | — | — | EP | disclosed |