Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | S100A4 | P26447 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | PTPRC | P08575 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2387154 | 0.71 | ALDH1A1 (0.50) | ACHEALDH1A1KMT2AMAPTCYP3A4 | |
| SCHEMBL4621603 | 0.71 | ACHE (0.56) | ACHES100A4ALDH1A1KMT2AMAPT | |
| SCHEMBL22463101 | 0.71 | ACHE (0.48) | ACHES100A4ALDH1A1KMT2AMAPT | |
| SCHEMBL31456585 | 0.70 | S100A4 (0.55) | ACHES100A4ALDH1A1KMT2AMAPT | |
| SCHEMBL28381941 | 0.70 | ACHE (0.58) | ACHES100A4ALDH1A1KMT2AMAPT | |
| SCHEMBL16283345 | 0.70 | S100A4 (0.44) | ACHES100A4ALDH1A1KMT2AMAPT | |
| SCHEMBL10566080 | 0.69 | ACHE (0.53) | ACHES100A4ALDH1A1KMT2AMAPT | |
| SCHEMBL3039191 | 0.69 | TDP1 (0.67) | ACHES100A4ALDH1A1KMT2AMAPT | |
| SCHEMBL28260841 | 0.68 | ALDH1A1 (0.50) | ACHEALDH1A1KMT2AMAPTCYP3A4 | |
| SCHEMBL31303745 | 0.68 | ACHE (0.48) | ACHES100A4ALDH1A1KMT2AMAPT |
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-108948019-A | Focal adhesion kinase inhibitor and application thereof | 广东东阳光药业有限公司 | 2018-12-07 | — | — | CN | disclosed |