Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | PLG | P00747 | 1/20 | 0.40 |
| ▸ | PLAU | P00749 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | KMO | O15229 | 2/20 | 0.38 |
| ▸ | ESR1 | P03372 | 2/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.38 |
| ▸ | GP6 | Q9HCN6 | 1/20 | 0.38 |
| ▸ | CDK4 | P11802 | 1/20 | 0.37 |
| ▸ | CCND1 | P24385 | 1/20 | 0.37 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.37 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.37 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10032456 | 1.00 | PARP1 (0.43) | PARP1MEN1RAB9AKMT2APLG | |
| SCHEMBL10032321 | 1.00 | PARP1 (0.43) | PARP1MEN1RAB9AKMT2APLG | |
| SCHEMBL10032361 | 1.00 | PARP1 (0.43) | PARP1MEN1RAB9AKMT2APLG | |
| SCHEMBL10032348 | 1.00 | PARP1 (0.43) | PARP1MEN1RAB9AKMT2APLG | |
| SCHEMBL10032457 | 0.97 | PARP1 (0.46) | PARP1MEN1RAB9AKMT2APLG | |
| SCHEMBL10032355 | 0.97 | PARP1 (0.46) | PARP1MEN1RAB9AKMT2APLG | |
| SCHEMBL21674508 | 0.95 | PARP1 (0.45) | PARP1MEN1RAB9AKMT2APLG | |
| SCHEMBL10032508 | 0.95 | PARP1 (0.45) | PARP1MEN1RAB9AKMT2APLG | |
| SCHEMBL10032407 | 0.94 | PARP1 (0.39) | PARP1MEN1RAB9AKMT2APLG | |
| SCHEMBL10032345 | 0.93 | PARP1 (0.45) | PARP1MEN1RAB9AKMT2APLG |
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-119080750-A | Light-emitting layer material with spiro structure, preparation method thereof and organic electroluminescent device | 中国科学技术大学 | 2024-12-06 | — | — | CN | disclosed |