Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | GFER | P55789 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | CDC7 | O00311 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.36 |
| ▸ | PIM1 | P11309 | 1/20 | 0.36 |
| ▸ | MAPKAPK2 | P49137 | 2/20 | 0.34 |
| ▸ | RNASEH1 | O60930 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MYC | P01106 | 1/20 | 0.33 |
| ▸ | MAX | P61244 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | XBP1 | P17861 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL27445670 | 0.85 | HPGD (0.47) | HPGDGFERHSD17B10LMNAPDK2 | |
| SCHEMBL27445524 | 0.81 | HPGD (0.46) | HPGDGFERHSD17B10CDC7LMNA | |
| SCHEMBL31351716 | 0.78 | CDC7 (0.43) | HPGDHSD17B10CDC7LMNAMAPKAPK2 | |
| SCHEMBL14991656 | 0.78 | HTR2A (0.47) | CDC7PGR | |
| SCHEMBL21768061 | 0.78 | CDC7 (0.41) | CDC7LMNAMAOAMAOBKDM4E | |
| SCHEMBL31351723 | 0.78 | CDC7 (0.43) | HPGDHSD17B10CDC7LMNAMAPKAPK2 | |
| SCHEMBL12078131 | 0.78 | TDP2 (0.46) | CDC7MAOAMAOBMEN1KMT2A | |
| SCHEMBL12545823 | 0.77 | HPGD (0.46) | HPGDGFERHSD17B10LMNAPDK2 | |
| SCHEMBL23329327 | 0.76 | HPGD (0.56) | HPGDGFERHSD17B10LMNAPDK2 | |
| SCHEMBL5738533 | 0.75 | MAPKAPK2 (0.52) | CDC7MAPKAPK2KDM4EMEN1ALDH1A1 |
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-2024119122-A1 | CDK INHIBITORS AND METHODS AND USE THEREOF | RELAY THERAPEUTICS, INC. (US) | 2024-06-06 | — | — | WO | disclosed |