Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FYN | P06241 | 5/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.41 |
| ▸ | KIT | P10721 | 2/20 | 0.41 |
| ▸ | MAP3K11 | Q16584 | 2/20 | 0.38 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.38 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.36 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | SMO | Q99835 | 1/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.35 |
| ▸ | DHPS | P49366 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2779998 | 0.92 | ROCK2 (0.42) | FYNROCK2KITPDGFRBPDGFRA | |
| SCHEMBL2782255 | 0.85 | PLAU (0.41) | FYNROCK2KITMAP3K11MAPK1 | |
| SCHEMBL2780849 | 0.84 | ADRA2A (0.50) | ROCK2MAPK1POLBKMT2ALMNA | |
| SCHEMBL2781278 | 0.83 | ROCK2 (0.42) | FYNROCK2PDGFRBPDGFRAMAPK1 | |
| SCHEMBL2784134 | 0.83 | ROCK2 (0.36) | ROCK2MAPK1NPSR1DHPSALDH1A1 | |
| SCHEMBL2783265 | 0.82 | SCN9A (0.40) | ROCK2MAPK1POLBKMT2ALMNA | |
| SCHEMBL2781085 | 0.81 | MAPK1 (0.46) | ROCK2MAPK1ROCK1ALDH1A1 | |
| SCHEMBL2781942 | 0.81 | HTT (0.52) | ROCK2POLBKMT2ALMNAHTT | |
| SCHEMBL2782470 | 0.81 | MAPK1 (0.43) | ROCK2MAPK1ROCK1ALDH1A1 | |
| SCHEMBL2379939 | 0.81 | PRMT5 (0.44) | FYNROCK2KITMAPK1POLB |
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 |
|---|---|---|---|---|---|---|---|
| US-9296697-B2 | Hetaryl-substituted guanidine compounds and use thereof as binding partners for 5-HT5-receptors | ABBOTT LABORATORIES (US) | 2016-03-29 | — | — | US | claimed |