Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.50 |
| ▸ | RAB9A | P51151 | 6/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.50 |
| ▸ | TP53 | P04637 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | ADCY1 | Q08828 | 1/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.47 |
| ▸ | RELA | Q04206 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | TPH1 | P17752 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29923054 | 0.93 | HDAC6 (0.49) | NPC1RAB9ASMN1; SMN2TP53ADCY1 | |
| SCHEMBL29923454 | 0.86 | NFKB1 (0.60) | NPC1RAB9ASMN1; SMN2TP53TSHR | |
| SCHEMBL29923042 | 0.86 | HDAC6 (0.57) | NPC1RAB9ASMN1; SMN2TP53ADCY1 | |
| SCHEMBL14814713 | 0.79 | HDAC1 (0.50) | NPC1RAB9ASMN1; SMN2TP53TSHR | |
| SCHEMBL19075478 | 0.77 | TSHR (0.57) | NPC1RAB9ASMN1; SMN2TP53TSHR | |
| SCHEMBL11902286 | 0.77 | HDAC1 (0.54) | NPC1RAB9ASMN1; SMN2TP53TSHR | |
| SCHEMBL19902687 | 0.75 | ALDH1A1 (0.47) | NPC1RAB9ASMN1; SMN2TP53TSHR | |
| SCHEMBL30147513 | 0.75 | HDAC6 (0.57) | NPC1RAB9ASMN1; SMN2TP53TSHR | |
| SCHEMBL17452651 | 0.75 | ALDH1A1 (0.47) | NPC1RAB9ASMN1; SMN2TP53TSHR | |
| SCHEMBL8825390 | 0.75 | ALDH1A1 (0.53) | NPC1RAB9ASMN1; SMN2TP53KMT2A |
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-110372626-B | Method for preparing 1,2, 4-oxadiazole compound | 河南大学 | 2022-11-08 | — | — | CN | claimed |
| CN-110372626-B | Method for preparing 1,2, 4-oxadiazole compound | 河南大学 | 2022-11-08 | — | — | CN | disclosed |