Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 3/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.40 |
| ▸ | CCR5 | P51681 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | RECQL | P46063 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | XBP1 | P17861 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 8/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL27845743 | 0.74 | CHRM2 (0.38) | CHRM2CHRM1LMNAGAAHTR2C | |
| SCHEMBL4839034 | 0.74 | CCR5 (0.44) | CHRM2CHRM1CCR5HTR2CHSD11B1 | |
| SCHEMBL10073178 | 0.72 | ADRB1 (0.41) | CHRM2CHRM1CCR5HTR2CHTR6 | |
| SCHEMBL11628818 | 0.72 | L3MBTL1 (0.47) | MAPTRECQLHTTLMNAHTR2C | |
| SCHEMBL9120393 | 0.71 | ADRB1 (0.38) | CHRM2CHRM1MAPTRECQLHTT | |
| SCHEMBL30754657 | 0.70 | ALDH1A1 (0.40) | HPGDHTR2CHTR6ALDH1A1 | |
| SCHEMBL3822494 | 0.69 | CACNA2D1 (0.41) | CHRM2CHRM1ATMALDH1A1 | |
| SCHEMBL23646035 | 0.68 | ALDH1A1 (0.37) | HTTHTR2CHTR6ALDH1A1 | |
| SCHEMBL736080 | 0.68 | CA1 (0.50) | MAPTHPGDLMNAGAAALDH1A1 | |
| SCHEMBL2266732 | 0.68 | LMNA (0.65) | CHRM2CHRM1HTTLMNAGAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115776983-A | Heterocyclic immunomodulators | 北京诺诚健华医药科技有限公司 | 2023-03-10 | — | — | CN | disclosed |
| CN-113896711-A | Heterocyclic immunomodulators | 北京诺诚健华医药科技有限公司 | 2022-01-07 | — | — | CN | disclosed |