Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | GPR27 | Q9NS67 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 2/20 | 0.37 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL17244915 | 1.00 | TSHR (0.47) | TSHRALDH1A1HTTGPR27MAPT | |
| SCHEMBL15706604 | 0.84 | TSHR (0.40) | TSHRALDH1A1HTTGPR27MAPT | |
| SCHEMBL17244916 | 0.84 | KCNK2 (0.43) | TSHRGPR27HDAC1HDAC6KDM1A | |
| SCHEMBL29825281 | 0.84 | KCNK2 (0.43) | TSHRGPR27HDAC1HDAC6KDM1A | |
| SCHEMBL246839 | 0.83 | CES2 (0.39) | TSHRALDH1A1GPR27SMN1; SMN2NPC1 | |
| SCHEMBL28224 | 0.83 | TSHR (0.58) | TSHRALDH1A1HTTMAPTSMN1; SMN2 | |
| SCHEMBL17244908 | 0.81 | TSHR (0.51) | TSHRALDH1A1HTTMAPTSMN1; SMN2 | |
| SCHEMBL14924942 | 0.81 | SMN1; SMN2 (0.46) | TSHRALDH1A1GPR27SMN1; SMN2NPC1 | |
| SCHEMBL1228531 | 0.80 | HTT (0.46) | ALDH1A1HTTMAPTSMN1; SMN2HPGD | |
| SCHEMBL20571340 | 0.79 | SOS1 (0.48) | TSHRALDH1A1GPR27MAPTHDAC1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112312905-B | Tetrazole-containing inhibitors of apoptosis signal-regulating kinase 1 and methods of use thereof | 英安塔制药有限公司 | 2024-03-15 | — | — | CN | disclosed |