Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.41 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2039680 | 0.93 | AAK1 (0.46) | HDAC1HDAC8PPARGMAPTGAA | |
| SCHEMBL2042553 | 0.86 | ACSS2 (0.51) | TDP1S1PR1 | |
| SCHEMBL2041827 | 0.82 | AAK1 (0.47) | NLRP3GAAAAK1SMN1; SMN2S1PR1 | |
| SCHEMBL2043182 | 0.81 | HDAC1 (0.42) | HDAC1HDAC8PPARGMAPTGAA | |
| SCHEMBL2040393 | 0.78 | S1PR1 (0.47) | PPARGGAAKDM4EHPGDSMN1; SMN2 | |
| SCHEMBL2042201 | 0.78 | NPSR1 (0.55) | TDP1HDAC1HDAC8MAPTGAA | |
| SCHEMBL2043795 | 0.77 | ACSS2 (0.49) | HDAC1HDAC8MAPTGAAKDM4E | |
| SCHEMBL2041269 | 0.76 | GAA (0.44) | HDAC1HDAC8MAPTGAAAAK1 | |
| SCHEMBL2038872 | 0.76 | GAA (0.41) | HDAC1HDAC8PPARGMAPTGAA | |
| SCHEMBL2039832 | 0.76 | ACSS2 (0.49) | GAAALDH1A1S1PR1 |
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-2011079087-A1 | ENAC BLOCKERS | GLAXO GROUP LIMITED (GB) | 2011-06-30 | — | — | WO | disclosed |