Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 1/20 | 0.46 |
| ▸ | CTSB | P07858 | 1/20 | 0.46 |
| ▸ | CTSS | P25774 | 1/20 | 0.46 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.45 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.45 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.45 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.45 |
| ▸ | OPRD1 | P41143 | 5/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.42 |
| ▸ | MME | P08473 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL25148528 | 0.86 | CTSL (0.49) | CTSLCTSBCTSSOPRD1OPRM1 | |
| SCHEMBL25873942 | 0.85 | CHRNB2 (0.52) | CHRNB2CHRNB4CHRNA3CHRNA4GRIA1 | |
| SCHEMBL25975240 | 0.85 | CHRNB2 (0.43) | CTSLCTSBCTSSCHRNB2CHRNB4 | |
| SCHEMBL25975345 | 0.83 | CHRNB2 (0.44) | CTSLCTSBCTSSCHRNB2CHRNB4 | |
| SCHEMBL29339855 | 0.83 | OPRD1 (0.51) | CTSLCTSBCTSSOPRD1OPRM1 | |
| SCHEMBL25873928 | 0.83 | CHRNB2 (0.47) | CHRNB2CHRNB4CHRNA3CHRNA4GRIA1 | |
| SCHEMBL25452475 | 0.82 | OPRD1 (0.51) | CTSLCTSBCTSSCHRNB2CHRNB4 | |
| SCHEMBL25887442 | 0.81 | HDAC3 (0.53) | CTSLCTSBCTSSCHRNB2CHRNB4 | |
| SCHEMBL25975656 | 0.81 | NPC1 (0.51) | KMT2A | |
| SCHEMBL25874361 | 0.81 | MMP2 (0.56) | CHRNB2CHRNB4CHRNA3CHRNA4GRIA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023178641-A1 | DNA TOXIC DIMER COMPOUND AND CONJUGATE THEREOF | 成都百利多特生物药业有限责任公司 | 2023-09-28 | — | — | WO | disclosed |