Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | BRD2 | P25440 | 1/20 | 0.40 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.40 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | ACP1 | P24666 | 1/20 | 0.36 |
| ▸ | SCD | O00767 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21499649 | 0.74 | MAPK1 (0.43) | MAPK1SMN1; SMN2CYP11B1CYP11B2HTT | |
| SCHEMBL21499645 | 0.70 | GDA (0.46) | SMN1; SMN2CYP11B1CYP11B2LMNAKMT2A | |
| SCHEMBL24247506 | 0.64 | BRD4 (0.33) | BRD4BRD2BRD3BRDT | |
| SCHEMBL30071806 | 0.64 | BRD4 (0.49) | MAPK1SMN1; SMN2CYP11B1CYP11B2HTT | |
| SCHEMBL16422771 | 0.62 | KMT2A (0.51) | MAPK1SMN1; SMN2CYP11B1CYP11B2HTT | |
| SCHEMBL22105567 | 0.61 | TSHR (0.45) | SMN1; SMN2CYP11B1CYP11B2BRD4TSHR | |
| SCHEMBL5532025 | 0.61 | RAB9A (0.65) | MAPK1SMN1; SMN2CYP11B1CYP11B2HTT | |
| SCHEMBL18072608 | 0.60 | SCD (0.46) | MAPK1SMN1; SMN2CYP11B1CYP11B2HTT | |
| SCHEMBL16423250 | 0.60 | KMT2A (0.49) | MAPK1SMN1; SMN2CYP11B1CYP11B2HTT | |
| SCHEMBL16076166 | 0.59 | LMNA (0.61) | MAPK1SMN1; SMN2HTTLMNABRD4 |
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-2970303-B9 | SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF | HYDRA BIOSCIENCES INC (US) | 2017-09-20 | — | — | EP | disclosed |