Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.64 |
| ▸ | KDR | P35968 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | PIM1 | P11309 | 1/20 | 0.48 |
| ▸ | AHR | P35869 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.46 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10654486 | 0.89 | GPR84 (0.59) | GPR84KDRALDH1A1MAPK1PBRM1 | |
| SCHEMBL10656794 | 0.89 | GPR84 (0.64) | GPR84KDRALDH1A1MAPK1PBRM1 | |
| SCHEMBL7370739 | 0.82 | GPR84 (0.66) | GPR84KDRALDH1A1MAPK1PBRM1 | |
| SCHEMBL2028344 | 0.80 | GPR84 (1.00) | GPR84ALDH1A1MAPK1PBRM1ATM | |
| SCHEMBL21438815 | 0.79 | GPR84 (0.71) | GPR84ALDH1A1MAPK1PBRM1ATM | |
| SCHEMBL10521630 | 0.77 | GPR84 (0.67) | GPR84ALDH1A1MAPK1PBRM1ATM | |
| SCHEMBL31711506 | 0.77 | GPR84 (0.67) | GPR84ALDH1A1MAPK1PBRM1ATM | |
| SCHEMBL29407899 | 0.76 | BCHE (0.58) | GPR84ALDH1A1MAPK1PBRM1ATM | |
| SCHEMBL21479840 | 0.76 | BCHE (0.58) | GPR84ALDH1A1MAPK1PBRM1ATM | |
| SCHEMBL10645520 | 0.74 | GPR84 (0.79) | GPR84KDRALDH1A1MAPK1PBRM1 |
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-105254626-B | A kind of ketone compounds of 2,3 diindyl of hexahydropyridine 2 and preparation method and application | 贵州大学 | 2018-02-23 | — | — | CN | disclosed |