Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM5B | Q9UGL1 | 11/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.32 |
| ▸ | CDK1 | P06493 | 2/20 | 0.32 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.32 |
| ▸ | GSK3A | P49840 | 2/20 | 0.32 |
| ▸ | GSK3B | P49841 | 2/20 | 0.32 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.32 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.32 |
| ▸ | CCNB3 | Q8WWL7 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | TLR9 | Q9NR96 | 3/20 | 0.32 |
| ▸ | TLR8 | Q9NR97 | 3/20 | 0.32 |
| ▸ | TLR7 | Q9NYK1 | 3/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | SIRT5 | Q9NXA8 | 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 | |
|---|---|---|---|---|
| SCHEMBL21721717 | 0.93 | KDM5B (0.46) | KDM5BTSHRCCNB2CDK1CCNB1 | |
| SCHEMBL20074303 | 0.85 | CCNB2 (0.47) | KDM5BTSHRCCNB2CDK1CCNB1 | |
| SCHEMBL20074113 | 0.85 | KDM5B (0.44) | KDM5BTSHRCCNB2CDK1CCNB1 | |
| SCHEMBL20074328 | 0.85 | KDM5B (0.44) | KDM5BTSHRCCNB2CDK1CCNB1 | |
| SCHEMBL20074318 | 0.85 | KDM5B (0.51) | KDM5BTSHRTDP1TLR9TLR8 | |
| SCHEMBL20074277 | 0.85 | KDM5B (0.42) | KDM5BTSHRCCNB2CDK1CCNB1 | |
| SCHEMBL20074320 | 0.84 | KDM5B (0.46) | KDM5BTSHRCCNB2CDK1CCNB1 | |
| SCHEMBL20074331 | 0.84 | KDM5B (0.43) | KDM5BTSHRCCNB2CDK1CCNB1 | |
| SCHEMBL21721741 | 0.83 | KDM5B (0.48) | KDM5BTSHR | |
| SCHEMBL21681712 | 0.83 | CCNB2 (0.49) | KDM5BTSHRCCNB2CDK1CCNB1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018071283-A1 | KDM5 INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2018-04-19 | — | — | WO | disclosed |