Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | MGAM | O43451 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | SI | P14410 | 1/20 | 0.36 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.36 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.35 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9794612 | 0.89 | TDP1 (0.48) | TDP1EGLN1ALDH1A1MEN1NPC1 | |
| SCHEMBL19323989 | 0.89 | TDP1 (0.48) | TDP1EGLN1ALDH1A1MEN1NPC1 | |
| SCHEMBL7672142 | 0.83 | TDP1 (0.42) | TDP1EGLN1ALDH1A1MEN1NPC1 | |
| SCHEMBL6668703 | 0.81 | TDP1 (0.41) | TDP1EGLN1ALDH1A1MEN1NPC1 | |
| SCHEMBL6251850 | 0.81 | MGAM (0.44) | TDP1EGLN1ALDH1A1MEN1NPC1 | |
| SCHEMBL9295748 | 0.81 | TDP1 (0.41) | TDP1EGLN1ALDH1A1MEN1NPC1 | |
| SCHEMBL9295744 | 0.81 | TDP1 (0.41) | TDP1EGLN1ALDH1A1MEN1NPC1 | |
| SCHEMBL29055376 | 0.79 | ALDH1A1 (0.39) | TDP1EGLN1ALDH1A1MEN1NPC1 | |
| SCHEMBL4257257 | 0.76 | MEN1 (0.38) | TDP1EGLN1ALDH1A1MEN1NPC1 | |
| SCHEMBL8653300 | 0.76 | TDP1 (0.52) | TDP1EGLN1ALDH1A1MEN1NPC1 |
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-103476776-B | 2,4-diaminourea-6,7-dihydro-5H-pyrrolo-[2,3] pyrimidine derivatives as FAK/Pyk2 inhibitor | 北京赛林泰医药技术有限公司 | 2016-09-28 | — | — | CN | disclosed |