Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 2/20 | 0.47 |
| ▸ | DHODH | Q02127 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.42 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 2/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | CTSD | P07339 | 1/20 | 0.40 |
| ▸ | KIT | P10721 | 2/20 | 0.39 |
| ▸ | KDR | P35968 | 2/20 | 0.39 |
| ▸ | FLT3 | P36888 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3881160 | 0.83 | CYP11B2 (0.50) | CYP11B2DHODHMAPTMKNK1MKNK2 | |
| SCHEMBL31051044 | 0.81 | DHODH (0.50) | CYP11B2DHODHMAPTNPC1CYP11B1 | |
| SCHEMBL3876408 | 0.81 | DHODH (0.50) | CYP11B2DHODHMAPTNPC1CYP11B1 | |
| SCHEMBL972023 | 0.80 | CYP11B2 (0.47) | CYP11B2DHODHMAPTMKNK1MKNK2 | |
| SCHEMBL12947927 | 0.80 | DHODH (0.48) | CYP11B2DHODHMAPTMKNK1MKNK2 | |
| SCHEMBL24196449 | 0.80 | CYP11B2 (0.47) | CYP11B2DHODHMAPTMKNK1MKNK2 | |
| SCHEMBL3875252 | 0.80 | CYP11B2 (0.55) | CYP11B2DHODHMAPTCYP11B1MAOA | |
| SCHEMBL13368032 | 0.80 | MKNK1 (0.62) | DHODHMKNK1MKNK2MAP4K4NPC1 | |
| SCHEMBL22230844 | 0.80 | CYP11B2 (0.47) | CYP11B2DHODHMAPTMKNK1MKNK2 | |
| SCHEMBL26785258 | 0.79 | MAP4K4 (0.69) | CYP11B2MAPTMKNK1MKNK2MAP4K4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022226203-A1 | PROTEASE INHIBITORS AND METHODS OF USE | THE CLEVELAND CLINIC FOUNDATION (US) | 2022-10-27 | — | — | WO | disclosed |
| WO-2016184652-A9 | METHODS FOR PRODUCING METALATED ORGANIC COMPOUNDS | LUDWIG-MAXIMILIANS-UNIVERSITÄT MÜNCHEN (DE) | 2017-08-10 | — | — | WO | disclosed |
| WO-2016184652-A1 | METHODS FOR PRODUCING METALATED ORGANIC COMPOUNDS | LUDWIG-MAXIMILIANS-UNIVERSITÄT MÜNCHEN (DE) | 2016-11-24 | — | — | WO | disclosed |