Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 10/20 | 0.53 |
| ▸ | MAPT | P10636 | 4/20 | 0.52 |
| ▸ | HTT | P42858 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | PKM | P14618 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.47 |
| ▸ | AR | P10275 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | CRHBP | P24387 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.46 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL13011218 | 0.82 | KMT2A (0.49) | MAPTKMT2APKMPOLBAR | |
| SCHEMBL13011350 | 0.82 | KMT2A (0.49) | MAPTKMT2APKMPOLBVCAM1 | |
| SCHEMBL14881451 | 0.81 | GRM6 (0.49) | MAPTHTTKMT2AALDH1A1LMNA | |
| SCHEMBL14879872 | 0.80 | THRB (0.54) | THRBMAPTHTTKMT2APKM | |
| SCHEMBL14882371 | 0.75 | ALDH1A1 (0.48) | MAPTHTTKMT2APKMALDH1A1 | |
| SCHEMBL3421516 | 0.75 | TUBB4A (0.42) | MAPTHTTKMT2APKMPOLB | |
| SCHEMBL3004155 | 0.74 | TUBB4A (0.48) | MAPTHTTKMT2APKMPOLB | |
| SCHEMBL14881445 | 0.73 | VCAM1 (0.57) | THRBMAPTKMT2AVCAM1ALDH1A1 | |
| SCHEMBL6815909 | 0.73 | KMT2A (0.59) | THRBMAPTKMT2APKMPOLB | |
| SCHEMBL573281 | 0.72 | VCAM1 (0.45) | THRBMAPTKMT2APOLBVCAM1 |
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-2013059648-A1 | 2,3,5 TRISUBSTITUTED ARYL AND HETEROARYL AMINO DERIVATIVES, COMPOSITIONS, AND METHODS OF USE | NEUROTHERAPEUTICS PHARMA, INC. (US) | 2013-04-25 | — | — | WO | disclosed |