Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 3/20 | 0.46 |
| ▸ | CTSS | P25774 | 3/20 | 0.46 |
| ▸ | CTSK | P43235 | 3/20 | 0.46 |
| ▸ | CTSH | P09668 | 1/20 | 0.46 |
| ▸ | APLNR | P35414 | 1/20 | 0.45 |
| ▸ | EPHA2 | P29317 | 2/20 | 0.44 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.43 |
| ▸ | RAMP3 | O60896 | 6/20 | 0.43 |
| ▸ | CALCR | P30988 | 6/20 | 0.43 |
| ▸ | CXCL8 | P10145 | 5/20 | 0.43 |
| ▸ | GRB2 | P62993 | 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 | |
|---|---|---|---|---|
| SCHEMBL30419528 | 0.93 | CTSL (0.44) | CTSLCTSSCTSKCTSHAPLNR | |
| SCHEMBL31157661 | 0.93 | CTSL (0.46) | CTSLCTSSCTSKCTSHAPLNR | |
| SCHEMBL31326909 | 0.91 | CXCR4 (0.45) | CTSLCTSSCTSKCTSHAPLNR | |
| SCHEMBL31031449 | 0.90 | EPHA2 (0.47) | EPHA2CXCR4RAMP3CALCR | |
| SCHEMBL29564535 | 0.89 | CXCR4 (0.40) | CTSLCTSSCTSKCTSHAPLNR | |
| SCHEMBL30185765 | 0.88 | APLNR (0.47) | APLNREPHA2CXCR4RAMP3CALCR | |
| SCHEMBL30601492 | 0.88 | APLNR (0.51) | APLNREPHA2RAMP3CALCR | |
| SCHEMBL31157707 | 0.86 | CTSL (0.51) | CTSLCTSSCTSKCTSHCXCL8 | |
| SCHEMBL29906662 | 0.86 | F2 (0.48) | CXCR4RAMP3CALCR | |
| SCHEMBL30716924 | 0.85 | NRP1 (0.45) | EPHA2RAMP3CALCRGRB2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114605522-A | MCL-1 and BCL-XL protein dual-targeting BH3 polypeptide mimics and application thereof | 中山大学 | 2022-06-10 | — | — | CN | claimed |
| CN-114605522-B | MCL-1 and BCL-XL protein dual-targeting BH3 polypeptide mimic and application thereof | 中山大学 | 2023-06-23 | — | — | CN | disclosed |
| CN-114605522-A | MCL-1 and BCL-XL protein dual-targeting BH3 polypeptide mimics and application thereof | 中山大学 | 2022-06-10 | — | — | CN | disclosed |