Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | GALR3 | O60755 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | KDM5A | P29375 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16591438 | 0.87 | PDPK1 (0.41) | PDPK1HSD17B10LMNASMN1; SMN2CYP1A2 | |
| SCHEMBL29450983 | 0.82 | PDPK1 (0.35) | PDPK1HSD17B10LMNASMN1; SMN2MAPT | |
| SCHEMBL22139947 | 0.82 | PDPK1 (0.35) | PDPK1HSD17B10LMNASMN1; SMN2MAPT | |
| SCHEMBL22139943 | 0.82 | HSD17B10 (0.38) | PDPK1HSD17B10LMNATSHRKDM4E | |
| SCHEMBL25517393 | 0.81 | TSHR (0.44) | LMNASMN1; SMN2HTTCYP1A2CYP2C9 | |
| SCHEMBL463190 | 0.79 | CDC7 (0.39) | NOS3NOS2ALDH1A1MEN1KMT2A | |
| SCHEMBL13535769 | 0.77 | HSD17B10 (0.33) | PDPK1HSD17B10KDM4EKMT2A | |
| SCHEMBL25734277 | 0.74 | MEN1 (0.32) | PDPK1HSD17B10MAPK1ALDH1A1MEN1 | |
| SCHEMBL13848218 | 0.74 | NOS3 (0.32) | CYP1A2CYP2D6CYP2C9CYP2C19NOS3 | |
| SCHEMBL12051534 | 0.73 | PDPK1 (0.41) | PDPK1HSD17B10LMNASMN1; SMN2CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023083297-A1 | SMALL MOLECULE INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 1 (USP1) AND USES THEREOF | INSILICO MEDICINE IP LIMITED (CN) | 2023-05-19 | — | — | WO | disclosed |
| WO-2023083286-A1 | SMALL MOLECULE INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 1 (USP1) AND USES THEREOF | INSILICO MEDICINE IP LIMITED (CN) | 2023-05-19 | — | — | WO | disclosed |