Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 2/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.38 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.37 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.36 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.36 |
| ▸ | NCF1 | P14598 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 6/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.35 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.35 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.35 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.35 |
| ▸ | HDAC10 | Q969S8 | 4/20 | 0.35 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.35 |
| ▸ | HDAC9 | Q9UKV0 | 4/20 | 0.35 |
| ▸ | HDAC5 | Q9UQL6 | 4/20 | 0.35 |
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 SCHEMBL6631199 | 1.00 | KEAP1 (0.38) | KEAP1NFE2L2ENPP1DPP8DPP7 | |
| Trifluoroacetic Acid SCHEMBL6627251 | 0.84 | DPP8 (0.39) | ENPP1DPP8DPP7HDAC6HDAC1 | |
| Trifluoroacetic Acid SCHEMBL6626913 | 0.82 | EPHX2 (0.42) | DPP8DPP7HDAC6HDAC1HDAC3 | |
| Trifluoroacetic Acid SCHEMBL6631761 | 0.82 | HDAC3 (0.41) | HDAC6HDAC1HDAC3HDAC4HDAC7 | |
| Trifluoroacetic Acid SCHEMBL6627244 | 0.82 | HDAC3 (0.41) | HDAC6HDAC1HDAC3HDAC4HDAC7 | |
| Trifluoroacetic Acid SCHEMBL6629104 | 0.78 | EPHX1 (0.45) | EPHX1ITGB3ITGA2B | |
| Trifluoroacetic Acid SCHEMBL6632396 | 0.78 | EPHX1 (0.45) | EPHX1ITGB3ITGA2B | |
| Trifluoroacetic Acid SCHEMBL6626871 | 0.78 | EPHX1 (0.45) | EPHX1ITGB3ITGA2B | |
| SCHEMBL29187171 | 0.76 | LIPA (0.42) | KEAP1NFE2L2NCF1GNAI3GNAO1 | |
| SCHEMBL26273947 | 0.76 | KEAP1 (0.43) | KEAP1NFE2L2NCF1GNAI3GNAO1 |
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-1027332-B1 | NOVEL LACTAM METALLOPROTEASE INHIBITORS | BRISTOL MYERS SQUIBB PHARMA CO (US) | 2004-05-26 | — | — | EP | disclosed |