Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | KMO | O15229 | 3/20 | 0.36 |
| ▸ | GABRP | O00591 | 1/20 | 0.34 |
| ▸ | GABRD | O14764 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.34 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.34 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.34 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.34 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.34 |
| ▸ | GABRE | P78334 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27584824 | 0.76 | GABRP (0.40) | MAPTALDH1A1KDM4CGABRPGABRD | |
| SCHEMBL18604297 | 0.76 | MAPT (0.54) | MAPTL3MBTL1ALDH1A1KDM4CTSHR | |
| SCHEMBL1094625 | 0.75 | L3MBTL1 (0.42) | MAPTL3MBTL1ALDH1A1KDM4CSMN1; SMN2 | |
| SCHEMBL27768259 | 0.73 | L3MBTL1 (0.42) | MAPTL3MBTL1ALDH1A1SMN1; SMN2NPSR1 | |
| SCHEMBL19668416 | 0.72 | TSHR (0.54) | L3MBTL1ALDH1A1SMN1; SMN2TSHRNPSR1 | |
| SCHEMBL28161833 | 0.71 | HCAR2 (0.35) | — | |
| SCHEMBL2234423 | 0.70 | MAPT (0.38) | MAPTL3MBTL1ALDH1A1KDM4CTSHR | |
| SCHEMBL6038491 | 0.69 | L3MBTL1 (0.41) | MAPTL3MBTL1ALDH1A1KDM4CSMN1; SMN2 | |
| SCHEMBL827405 | 0.69 | ALDH1A1 (0.41) | MAPTL3MBTL1ALDH1A1 | |
| SCHEMBL5104290 | 0.68 | L3MBTL1 (0.42) | MAPTL3MBTL1ALDH1A1SMN1; SMN2KDM4E |
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-101472920-A | Selective inhibitors of ROCK protein kinase and uses thereof | VERTEX PHARMA (US) | 2009-07-01 | — | — | CN | disclosed |