Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 5/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.40 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.40 |
| ▸ | TLR2 | O60603 | 1/20 | 0.39 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.39 |
| ▸ | TLR6 | Q9Y2C9 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | CASP6 | P55212 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.36 |
| ▸ | TRIM24 | O15164 | 2/20 | 0.35 |
| ▸ | TRIM33 | Q9UPN9 | 2/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23093262 | 1.00 | ERN1 (0.44) | ERN1CYP2A6PDPK1TLR2TLR1 | |
| SCHEMBL610449 | 0.83 | PDPK1 (0.48) | CYP2A6PDPK1ADORA2AADORA1RAB9A | |
| Hydrochloric Acid SCHEMBL19894001 | 0.82 | PDPK1 (0.47) | CYP2A6PDPK1ADORA2AADORA1RAB9A | |
| SCHEMBL1954807 | 0.78 | PDPK1 (0.46) | CYP2A6PDPK1ADORA2AADORA1CASP6 | |
| SCHEMBL23108267 | 0.78 | CA1 (0.46) | ERN1CYP2A6PDPK1TLR2TLR1 | |
| SCHEMBL29833478 | 0.76 | ERN1 (0.51) | ERN1SMPD3HSP90AA1 | |
| SCHEMBL23249815 | 0.76 | ADORA2A (0.48) | CYP2A6PDPK1ADORA2AADORA1CASP6 | |
| SCHEMBL16439936 | 0.75 | ERN1 (0.67) | ERN1TLR2TLR1TLR6TRIM24 | |
| SCHEMBL31152506 | 0.75 | ERN1 (0.67) | ERN1TLR2TLR1TLR6TRIM24 | |
| SCHEMBL23092920 | 0.74 | HTR2B (0.44) | ERN1CYP2A6TLR2TLR1TLR6 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114478514-B | Fluorescent molecular probe with aggregation-induced emission characteristic and preparation method and application thereof | 湖南省肿瘤医院 | 2023-04-18 | — | — | CN | claimed |
| CN-114478514-A | Fluorescent molecular probe with aggregation-induced emission characteristic and preparation method and application thereof | 湖南省肿瘤医院 | 2022-05-13 | — | — | CN | claimed |
| CN-114478514-B | Fluorescent molecular probe with aggregation-induced emission characteristic and preparation method and application thereof | 湖南省肿瘤医院 | 2023-04-18 | — | — | CN | disclosed |
| CN-114478514-B | Fluorescent molecular probe with aggregation-induced emission characteristic and preparation method and application thereof | 湖南省肿瘤医院 | 2023-04-18 | — | — | CN | disclosed |
| CN-114478514-A | Fluorescent molecular probe with aggregation-induced emission characteristic and preparation method and application thereof | 湖南省肿瘤医院 | 2022-05-13 | — | — | CN | disclosed |
| CN-114478514-A | Fluorescent molecular probe with aggregation-induced emission characteristic and preparation method and application thereof | 湖南省肿瘤医院 | 2022-05-13 | — | — | CN | disclosed |