Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 4/20 | 0.46 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.46 |
| ▸ | AURKA | O14965 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | ENPP1 | P22413 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.43 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.43 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.43 |
| ▸ | ABL1 | P00519 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | BCR | P11274 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL17740425 | 0.82 | ENPP1 (0.46) | PARP1PLA2G2AALOX15PTGS2AURKA | |
| SCHEMBL2010618 | 0.81 | CNR2 (0.48) | PARP1 | |
| SCHEMBL8814866 | 0.80 | KDM4E (0.61) | PARP1PLA2G2AALOX15PTGS2AURKA | |
| SCHEMBL8818573 | 0.78 | MGAM (0.60) | PARP1PLA2G2AALOX15PTGS2AURKA | |
| SCHEMBL716477 | 0.74 | CBFB (0.54) | PARP1ALOX15AURKANPC1RAB9A | |
| SCHEMBL14823682 | 0.72 | NPC1 (0.39) | PARP1PLA2G2AALOX15PTGS2AURKA | |
| SCHEMBL3187259 | 0.71 | ABL1 (0.57) | PTGS2NPC1RAB9ASMN1; SMN2ENPP1 | |
| SCHEMBL29878398 | 0.71 | ENPP1 (0.44) | NPC1RAB9AALDH1A1SMN1; SMN2ENPP1 | |
| SCHEMBL8816887 | 0.70 | PARP1 (0.53) | PARP1PLA2G2AALOX15PTGS2AURKA | |
| SCHEMBL8814869 | 0.70 | PARP1 (0.62) | PARP1AURKAKDM4ENPC1RAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2691095-A2 | IMIDAZOLYL AMIDE COMPOUNDS AND USES RELATED THERETO | Emory University (US) | 2014-02-05 | — | — | EP | disclosed |
| WO-2012135296-A2 | IMIDAZOLYL AMIDE COMPOUNDS AND USES RELATED THERETO | EMORY UNIVERSITY (US) | 2012-10-04 | — | — | WO | disclosed |