Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 8/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | KDR | P35968 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.33 |
| ▸ | FLT3 | P36888 | 2/20 | 0.33 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3328090 | 0.83 | ALDH1A1 (0.46) | NISCHROCK2ROCK1KDRPOLB | |
| SCHEMBL8235455 | 0.81 | ROCK1 (0.32) | ROCK1RAB9AKDRNPC1PDE3B | |
| Trifluoroacetic Acid SCHEMBL3328120 | 0.76 | KDR (0.40) | ROCK2ROCK1KDRPOLBFLT3 | |
| SCHEMBL3326596 | 0.74 | NPC1 (0.47) | RAB9AKDRNPC1POLBFLT3 | |
| SCHEMBL8215800 | 0.72 | TAAR1 (0.63) | TAAR1RAB9ANPC1POLBSMN1; SMN2 | |
| SCHEMBL8218265 | 0.70 | ROCK1 (0.43) | TAAR1ROCK2ROCK1RAB9ANPC1 | |
| SCHEMBL3324137 | 0.69 | KIF11 (0.47) | ROCK2ROCK1KDRPOLBSMN1; SMN2 | |
| SCHEMBL10474308 | 0.68 | KCNH2 (0.54) | RAB9ANPC1PDE3BSMN1; SMN2MAPT | |
| SCHEMBL8207992 | 0.68 | KIF11 (0.58) | RAB9ANPC1HTTALDH1A1MAPT | |
| SCHEMBL16356391 | 0.68 | MAPT (0.54) | L3MBTL1KDM4EALDH1A1MAPT |
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-2007064732-A1 | COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS AND MICROBIAL DISEASES | SCHERING CORPORATION (US) | 2007-06-07 | — | — | WO | disclosed |