Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 6/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.41 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.41 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20987622 | 0.98 | HDAC8 (0.44) | TDP1CNR2HDAC8HDAC3HDAC6 | |
| SCHEMBL28681232 | 0.98 | HDAC8 (0.44) | TDP1CNR2HDAC8HDAC3HDAC6 | |
| SCHEMBL5875341 | 0.98 | HDAC8 (0.44) | TDP1CNR2HDAC8HDAC3HDAC6 | |
| SCHEMBL23861793 | 0.98 | HDAC8 (0.44) | TDP1CNR2HDAC8HDAC3HDAC6 | |
| SCHEMBL19271855 | 0.98 | HDAC8 (0.44) | TDP1CNR2HDAC8HDAC3HDAC6 | |
| SCHEMBL25124425 | 0.98 | ENPP2 (0.43) | TDP1CNR2HDAC8HDAC3HDAC6 | |
| SCHEMBL4688472 | 0.98 | HDAC8 (0.44) | TDP1CNR2HDAC8HDAC3HDAC6 | |
| SCHEMBL21499101 | 0.98 | HDAC8 (0.44) | TDP1CNR2HDAC8HDAC3HDAC6 | |
| SCHEMBL10633066 | 0.96 | HDAC8 (0.43) | TDP1CNR2HDAC8HDAC3HDAC6 | |
| SCHEMBL24404172 | 0.94 | HDAC8 (0.43) | TDP1CNR2HDAC8HDAC3HDAC6 |
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-9662335-B2 | Heteroaryl substituted pyrrolo[2,3-B] pyridines and pyrrolo[2,3-B] pyrimidines as janus kinase inhibitors | INCYTE HOLDINGS CORPORATION (US) | 2017-05-30 | — | — | US | disclosed |