Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | KMO | O15229 | 2/20 | 0.33 |
| ▸ | ASPH | Q12797 | 1/20 | 0.32 |
| ▸ | KDM8 | Q8N371 | 1/20 | 0.32 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.32 |
| ▸ | DAO | P14920 | 1/20 | 0.32 |
| ▸ | APAF1 | O14727 | 1/20 | 0.31 |
| ▸ | TDP2 | O95551 | 1/20 | 0.31 |
| ▸ | NSD2 | O96028 | 1/20 | 0.31 |
| ▸ | CASP3 | P42574 | 1/20 | 0.31 |
| ▸ | PPP1CA | P62136 | 1/20 | 0.31 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.31 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.31 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.31 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.31 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.31 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28325423 | 0.84 | KDM4E (0.44) | KDM4EALDH1A1SMN1; SMN2KMOASPH | |
| SCHEMBL15991059 | 0.82 | BRAF (0.35) | KDM4EALDH1A1SMN1; SMN2ASPHKDM8 | |
| SCHEMBL22118239 | 0.79 | KMO (0.38) | KDM4EALDH1A1SMN1; SMN2KMOASPH | |
| SCHEMBL9956653 | 0.73 | KDM4E (0.44) | KDM4EALDH1A1SMN1; SMN2TLR7CYP3A4 | |
| SCHEMBL28007367 | 0.72 | ALDH1A1 (0.39) | KDM4EALDH1A1SMN1; SMN2ASPHKDM8 | |
| SCHEMBL698878 | 0.70 | TSHR (0.37) | KDM4EALDH1A1ASPHKDM8TLR7 | |
| SCHEMBL22980311 | 0.70 | — | — | |
| SCHEMBL31601638 | 0.69 | DPP4 (0.38) | KDM4EALDH1A1SMN1; SMN2KMOASPH | |
| SCHEMBL19785247 | 0.69 | — | — | |
| SCHEMBL1337861 | 0.69 | — | — |
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-110214136-A | Pyrazole derivatives as MALT1 inhibitor | 詹森药业有限公司 | 2019-09-06 | — | — | CN | disclosed |