Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.47 |
| ▸ | PTGDR2 | Q9Y5Y4 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 3/20 | 0.42 |
| ▸ | PPARG | P37231 | 2/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.42 |
| ▸ | BRS3 | P32247 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | PPARD | Q03181 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | ALPL | P05186 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | CASP3 | P42574 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28057576 | 0.82 | MMP13 (0.46) | GPR84PTGDR2MAPTTDP1PPARA | |
| SCHEMBL28262433 | 0.77 | GPR84 (0.49) | GPR84MAPTTDP1TAAR1MEN1 | |
| SCHEMBL28057539 | 0.76 | GPR84 (0.42) | GPR84PTGDR2MAPTTDP1PPARA | |
| SCHEMBL1387583 | 0.71 | ALDH1A1 (0.42) | MAPTBRS3ALDH1A1NFKB1 | |
| SCHEMBL11596852 | 0.70 | PLA2G4B (0.56) | PTGDR2PPARGTAAR1MEN1KMT2A | |
| SCHEMBL355627 | 0.69 | L3MBTL1 (0.67) | PPARAPPARGMCL1TAAR1MEN1 | |
| SCHEMBL8582394 | 0.68 | L3MBTL1 (0.61) | MCL1 | |
| SCHEMBL7345076 | 0.68 | BRS3 (0.49) | BRS3TAAR1 | |
| SCHEMBL120716 | 0.68 | KMT2A (0.58) | PPARAMEN1KMT2AALDH1A1LMNA | |
| SCHEMBL28536384 | 0.66 | PPARA (0.63) | PPARAMEN1KMT2AALDH1A1RAB9A |
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-105431416-A | 4-alkynyl imidazole derivative and medicine comprising same as active ingredient | KAKEN PHARMA CO LTD | 2016-03-23 | — | — | CN | disclosed |