Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CDK4 | P11802 | 1/20 | 0.37 |
| ▸ | CCND1 | P24385 | 1/20 | 0.37 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | ESRRG | P62508 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.34 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22859165 | 0.76 | POLB (0.37) | POLBCDK4CCND1ESRRGMAPT | |
| SCHEMBL22858979 | 0.76 | POLB (0.37) | POLBCDK4CCND1ESRRGMAPT | |
| SCHEMBL28502196 | 0.76 | POLB (0.37) | POLBCDK4CCND1ESRRGMAPT | |
| SCHEMBL21590176 | 0.76 | MLYCD (0.45) | POLBCDK4CCND1CES2CES1 | |
| SCHEMBL28502010 | 0.74 | NPC1 (0.44) | POLBALDH1A1HPGDHDAC3HDAC1 | |
| SCHEMBL12101326 | 0.69 | HDAC4 (0.47) | POLBCDK4CCND1CES2CES1 | |
| SCHEMBL12377306 | 0.69 | ESRRG (0.45) | ESRRGALDH1A1HPGDHDAC6HDAC1 | |
| SCHEMBL19581035 | 0.68 | LMNA (0.48) | POLBCES2CES1MAPTALDH1A1 | |
| SCHEMBL6034132 | 0.66 | CDK4 (0.51) | POLBCDK4CCND1CES2CES1 | |
| SCHEMBL22922406 | 0.66 | CDK4 (0.51) | POLBCDK4CCND1CES2CES1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112243439-A | Pyrrolo [2,3-B ] pyridines or pyrrolo [2,3-B ] pyrazines as HPK1 inhibitors and uses thereof | 百济神州有限公司 | 2021-01-19 | — | — | CN | disclosed |