Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIP5K1C | O60331 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 4/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.32 |
| ▸ | IDH1 | O75874 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 3/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | USP2 | O75604 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | HPGDS | O60760 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL31614760 | 0.82 | SMN1; SMN2 (0.36) | SMN1; SMN2KDM4ETSHRLMNANR4A1 | |
| SCHEMBL20042990 | 0.81 | CNR1 (0.37) | SMN1; SMN2KDM4EALDH1A1TSHRLMNA | |
| SCHEMBL31614810 | 0.78 | CHRM4 (0.42) | PDE4BPDE4D | |
| SCHEMBL20042858 | 0.77 | ALDH1A1 (0.37) | SMN1; SMN2KDM4EALDH1A1TSHRLMNA | |
| SCHEMBL31615020 | 0.77 | PDE10A (0.35) | SMN1; SMN2KDM4EALDH1A1NPC1TSHR | |
| SCHEMBL20042875 | 0.77 | PDE10A (0.35) | SMN1; SMN2KDM4EALDH1A1NPC1TSHR | |
| SCHEMBL31615013 | 0.77 | PDE10A (0.35) | SMN1; SMN2KDM4EALDH1A1NPC1TSHR | |
| SCHEMBL31614910 | 0.77 | PDE10A (0.35) | SMN1; SMN2KDM4EALDH1A1NPC1TSHR | |
| SCHEMBL20042742 | 0.76 | PROKR1 (0.35) | SMN1; SMN2KDM4EALDH1A1HSD17B10MEN1 | |
| Hydrochloric Acid SCHEMBL31614990 | 0.75 | PARP1 (0.34) | SMN1; SMN2KDM4ETSHRLMNANR4A1 |
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-2018066718-A1 | THERAPEUTIC COMPOUNDS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-04-12 | — | — | WO | disclosed |