Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.41 |
| ▸ | DHODH | Q02127 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.39 |
| ▸ | NEK1 | Q96PY6 | 1/20 | 0.38 |
| ▸ | PRKDC | P78527 | 1/20 | 0.38 |
| ▸ | ATR | Q13535 | 1/20 | 0.38 |
| ▸ | CDK8 | P49336 | 1/20 | 0.38 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.38 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL17220079 | 0.91 | PIM1 (0.43) | DYRK1ADHODHPRKDCATRATM | |
| Trifluoroacetic Acid SCHEMBL17220420 | 0.90 | AURKA (0.42) | MAPTALDH1A1HPGDATMGRIN1 | |
| SCHEMBL13579635 | 0.90 | AURKA (0.44) | MAPTNPC1RAB9ASMN1; SMN2KDM4E | |
| Trifluoroacetic Acid SCHEMBL17220303 | 0.89 | KDR (0.40) | DHODHPIN1ATRCDK8GRIN1 | |
| Trifluoroacetic Acid SCHEMBL17219987 | 0.85 | AURKA (0.41) | PIN1CDK8LRRK2 | |
| Trifluoroacetic Acid SCHEMBL17220020 | 0.85 | GRIN1 (0.46) | KDM4EDHODHHSD17B10PIN1GRIN1 | |
| Trifluoroacetic Acid SCHEMBL17220129 | 0.85 | KDR (0.42) | KDM4ECDK8GRIN1GRIN2BLRRK2 | |
| SCHEMBL13579627 | 0.84 | PIM1 (0.46) | DYRK1APRKDCATRATMGRIN1 | |
| Trifluoroacetic Acid SCHEMBL17220344 | 0.84 | KDR (0.45) | SMN1; SMN2KDM4EALDH1A1HPGDHSD17B10 | |
| Trifluoroacetic Acid SCHEMBL17220085 | 0.82 | AURKA (0.40) | MAPTRAB9ASMN1; SMN2KDM4EALDH1A1 |
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-2299821-B1 | TRICYCLIC COMPOUNDS | ABBVIE INC (US) | 2015-11-04 | — | — | EP | disclosed |