Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | STS | P08842 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | SYK | P43405 | 1/20 | 0.41 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.41 |
| ▸ | PREP | P48147 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.41 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4738328 | 0.86 | OPRD1 (0.53) | ABCB1HTTPARP1KDM4EPKM | |
| SCHEMBL337363 | 0.86 | OPRD1 (0.53) | ABCB1HTTPARP1KDM4EPKM | |
| SCHEMBL336766 | 0.86 | OPRD1 (0.53) | ABCB1HTTPARP1KDM4EPKM | |
| SCHEMBL20528094 | 0.85 | KDM1A (0.53) | ABCB1ALDH1A1PARP1PREPFKBP1A | |
| SCHEMBL20522962 | 0.85 | KDM1A (0.53) | ABCB1ALDH1A1PARP1PREPFKBP1A | |
| SCHEMBL30511036 | 0.85 | KDM1A (0.53) | ABCB1ALDH1A1PARP1PREPFKBP1A | |
| SCHEMBL5241449 | 0.84 | ALDH1A1 (0.51) | ABCB1SMN1; SMN2NPC1RAB9AHTT | |
| SCHEMBL20571847 | 0.83 | ABCB1 (0.49) | ABCB1SMN1; SMN2NPC1RAB9AHTT | |
| SCHEMBL27782500 | 0.83 | SMN1; SMN2 (0.46) | SMN1; SMN2NPC1RAB9AHTTSTS | |
| SCHEMBL18989117 | 0.82 | ABCB1 (0.48) | ABCB1HTTPARP1MAPTKDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101565420-B | Limk2 inhibitors, compositions comprising them, and methods of their use | LEXICON PHARMACEUTICALS INC | 2015-05-20 | — | — | CN | disclosed |
| CN-101565420-A | LIMK2 inhibitors, compositions comprising them, and methods of their use | LEXICON PHARMACEUTICALS INC (US) | 2009-10-28 | — | — | CN | disclosed |