Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 7/20 | 0.65 |
| ▸ | MEN1 | O00255 | 6/20 | 0.65 |
| ▸ | MAPT | P10636 | 5/20 | 0.65 |
| ▸ | TP53 | P04637 | 2/20 | 0.65 |
| ▸ | THRB | P10828 | 1/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.63 |
| ▸ | POLB | P06746 | 1/20 | 0.63 |
| ▸ | ATM | Q13315 | 1/20 | 0.60 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.56 |
| ▸ | UBE2N | P61088 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | RAB9A | P51151 | 3/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | AHR | P35869 | 1/20 | 0.52 |
| ▸ | GFER | P55789 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL28156741 | 0.89 | MAPT (0.57) | KMT2AMEN1MAPTTP53THRB | |
| SCHEMBL28156720 | 0.84 | MAPT (0.64) | KMT2AMEN1MAPTTP53ALDH1A1 | |
| SCHEMBL16246327 | 0.81 | CFTR (0.60) | KMT2AMEN1MAPTTP53THRB | |
| SCHEMBL28953644 | 0.80 | ALDH1A1 (0.64) | KMT2AMEN1MAPTTP53ALDH1A1 | |
| SCHEMBL28157304 | 0.79 | KMT2A (0.66) | KMT2AMEN1MAPTTP53THRB | |
| SCHEMBL28157289 | 0.76 | MAPT (0.61) | KMT2AMEN1MAPTTP53THRB | |
| SCHEMBL28157272 | 0.74 | LMNA (0.51) | KMT2AMEN1MAPTTP53THRB | |
| SCHEMBL28157411 | 0.73 | KDM1A (0.55) | KMT2AMEN1MAPTALDH1A1POLB | |
| SCHEMBL28157299 | 0.73 | MAPT (0.66) | KMT2AMEN1MAPTTP53ALDH1A1 | |
| SCHEMBL28157274 | 0.72 | KAT6A (0.57) | KMT2AMEN1MAPTALDH1A1POLB |
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-105531268-B | Noval chemical compound and its pharmaceutical composition for treating cystic fibrosis | 加拉佩格斯股份有限公司 | 2017-09-12 | — | — | CN | disclosed |