Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | PTGER4 | P35408 | 3/20 | 0.43 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | GSK3A | P49840 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27848902 | 0.88 | AKR1C3 (0.55) | AKR1C3PTGER4AKR1C2ALDH1A1MEN1 | |
| SCHEMBL20531569 | 0.86 | GAA (0.45) | AKR1C3GAAAKR1C2SMN1; SMN2MAPT | |
| SCHEMBL27633657 | 0.85 | MAPT (0.46) | AKR1C3GAAPTGER4AKR1C2MAPT | |
| SCHEMBL27830488 | 0.76 | CA1 (0.47) | GAASMN1; SMN2MAPTALDH1A1KDM4E | |
| SCHEMBL1412486 | 0.74 | UCHL1 (0.52) | AKR1C3GAAPTGER4AKR1C2SMN1; SMN2 | |
| SCHEMBL27830557 | 0.74 | PTGER4 (0.53) | AKR1C3PTGER4 | |
| SCHEMBL20531597 | 0.73 | SMN1; SMN2 (0.49) | GAASMN1; SMN2MAPTALDH1A1KDM4E | |
| SCHEMBL22816780 | 0.72 | AKR1C3 (0.48) | AKR1C3PTGER4AKR1C2TP53ALOX15 | |
| SCHEMBL22815854 | 0.72 | AKR1C3 (0.49) | AKR1C3PTGER4AKR1C2MAPTTP53 | |
| SCHEMBL939419 | 0.71 | HPGD (0.51) | AKR1C3GAAPTGER4AKR1C2SMN1; SMN2 |
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-110022875-A | Therapeutic inhibiting compound | 莱福斯希医药公司 | 2019-07-16 | — | — | CN | disclosed |