Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 7/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.42 |
| ▸ | HRH1 | P35367 | 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 | |
|---|---|---|---|---|
| SCHEMBL14681114 | 0.87 | SIGMAR1 (0.59) | SIGMAR1MAPTTP53ADRA2AADRA2B | |
| SCHEMBL7712083 | 0.84 | SIGMAR1 (0.63) | SIGMAR1 | |
| SCHEMBL3043755 | 0.83 | SIGMAR1 (0.54) | SIGMAR1MAPTADRA2AADRA2BADRA2C | |
| SCHEMBL17288108 | 0.83 | SIGMAR1 (0.51) | SIGMAR1MAPTSMN1; SMN2TP53ADRA2A | |
| SCHEMBL7716707 | 0.83 | SIGMAR1 (0.51) | SIGMAR1ADRA2AADRA2BADRA2CHRH1 | |
| SCHEMBL2403333 | 0.81 | SIGMAR1 (0.50) | SIGMAR1MAPTSMN1; SMN2 | |
| SCHEMBL2073651 | 0.81 | SIGMAR1 (0.59) | SIGMAR1MAPTADRA2AADRA2BADRA2C | |
| SCHEMBL3045443 | 0.80 | MAPT (0.54) | SIGMAR1MAPTSMN1; SMN2TP53ADRA2A | |
| SCHEMBL11038312 | 0.80 | MAPT (0.48) | SIGMAR1MAPTSMN1; SMN2TP53ADRA2A | |
| SCHEMBL7713334 | 0.78 | SIGMAR1 (0.53) | SIGMAR1MAPTSMN1; SMN2ADRA2AADRA2B |
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-113087683-B | Nitrogen-substituted benzothiazolinone XOR/URAT1 dual inhibitor and preparation method and application thereof | 华南理工大学 | 2022-04-22 | — | — | CN | disclosed |
| CN-113087683-A | Nitrogen-substituted benzothiazolinone XOR/URAT1 dual inhibitor and preparation method and application thereof | 华南理工大学 | 2021-07-09 | — | — | CN | disclosed |