Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RBP4 | P02753 | 2/20 | 0.43 |
| ▸ | TTR | P02766 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | KDM5A | P29375 | 1/20 | 0.41 |
| ▸ | JMJD1C | Q15652 | 1/20 | 0.41 |
| ▸ | KDM3A | Q9Y4C1 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 3/20 | 0.40 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.40 |
| ▸ | CDC7 | O00311 | 1/20 | 0.40 |
| ▸ | SLC6A7 | Q99884 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GNE | Q9Y223 | 1/20 | 0.36 |
| ▸ | WNT1 | P04628 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL20745949 | 0.88 | ACHE (0.52) | RBP4TTRKDM4EKDM5AJMJD1C | |
| SCHEMBL28070878 | 0.84 | MAPK8 (0.52) | RBP4TTRKDM4EKDM5AJMJD1C | |
| SCHEMBL15188017 | 0.83 | ACHE (0.49) | RBP4TTRKDM4EACHESLC6A7 | |
| SCHEMBL22262452 | 0.83 | CRBN (0.52) | RBP4KDM4EACHECYP2C19ALDH1A1 | |
| SCHEMBL28087268 | 0.83 | MAPK8 (0.54) | RBP4TTRKDM4EKDM5AJMJD1C | |
| SCHEMBL3116636 | 0.80 | POLB (0.54) | RBP4KDM4EACHEALDH1A1 | |
| SCHEMBL31706055 | 0.80 | POLB (0.54) | RBP4KDM4EACHEALDH1A1 | |
| SCHEMBL28059123 | 0.80 | ADRB1 (0.54) | RBP4TTRKDM4EKDM5AJMJD1C | |
| SCHEMBL31706765 | 0.78 | RBP4 (0.44) | RBP4TTRKDM4EKDM5AJMJD1C | |
| SCHEMBL31346934 | 0.78 | RBP4 (0.45) | RBP4TTRKDM4EKDM5AJMJD1C |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3668502-A1 | MACROCYCLIC MCL-1 INHIBITORS AND METHODS OF USE | AbbVie Inc. (US) | 2020-06-24 | — | — | EP | disclosed |
| WO-2019035927-A1 | MACROCYCLIC MCL-1 INHIBITORS AND METHODS OF USE | ABBVIE INC. (US) | 2019-02-21 | — | — | WO | disclosed |