Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.68 |
| ▸ | CDC25B | P30305 | 2/20 | 0.63 |
| ▸ | PLK1 | P53350 | 1/20 | 0.54 |
| ▸ | HPGDS | O60760 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | STAT6 | P42226 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | TTR | P02766 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL4469856 | 0.88 | CDC25B (0.78) | HTTCDC25BPLK1HPGDSCYP2C9 | |
| SCHEMBL10420596 | 0.88 | CDC25B (0.57) | HTTCDC25BPLK1HPGDSCYP2C9 | |
| Hydrochloric Acid SCHEMBL11445757 | 0.86 | CDC25B (0.76) | HTTCDC25BPLK1HPGDSCYP2C9 | |
| Cyanide SCHEMBL11198616 | 0.83 | CDC25B (0.71) | HTTCDC25BPLK1HPGDSCYP2C9 | |
| SCHEMBL7560388 | 0.83 | CDC25B (0.88) | HTTCDC25BPLK1HPGDSCYP2C9 | |
| SCHEMBL7536268 | 0.82 | NR4A1 (0.59) | CDC25BHPGDKMT2AALDH1A1HSD17B10 | |
| SCHEMBL4103770 | 0.81 | CDC25B (0.68) | HTTCDC25BPLK1HPGDSCYP2C9 | |
| SCHEMBL3384527 | 0.81 | HTT (1.00) | HTTCDC25BCYP2C9HPGDMAPT | |
| SCHEMBL28066296 | 0.81 | CDC25B (0.57) | HTTCDC25BPLK1HPGDSCYP2C9 | |
| SCHEMBL28828357 | 0.81 | CXCL8 (0.50) | HTTCDC25BPLK1ALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-105473548-A | Amide derivatives as lysophosphatidic acid receptor antagonists | TAKEDA PHARMACEUTICALS CO | 2016-04-06 | — | — | CN | disclosed |