Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28652352 | 0.91 | KMT2A (0.48) | TSHRKMT2APARP1PARP2TP53 | |
| SCHEMBL28639031 | 0.90 | KMT2A (0.57) | TSHRKMT2AMEN1PARP1HSP90AA1 | |
| SCHEMBL28647774 | 0.89 | MEN1 (0.44) | TSHRKMT2AMEN1MAPTSMN1; SMN2 | |
| SCHEMBL30604585 | 0.82 | MEN1 (0.47) | TSHRKMT2AMEN1MAPTSMN1; SMN2 | |
| SCHEMBL28640895 | 0.82 | HSP90AA1 (0.43) | TSHRKMT2AMEN1MAPTHSP90AA1 | |
| SCHEMBL28633459 | 0.82 | MEN1 (0.47) | TSHRKMT2AMEN1MAPTSMN1; SMN2 | |
| SCHEMBL30604600 | 0.82 | HSP90AA1 (0.43) | TSHRKMT2AMEN1MAPTHSP90AA1 | |
| SCHEMBL28638165 | 0.81 | MEN1 (0.57) | TSHRKMT2AMEN1PARP1SMN1; SMN2 | |
| SCHEMBL28925170 | 0.81 | CASP3 (0.47) | TSHRKMT2AMEN1MAPTSMN1; SMN2 | |
| SCHEMBL28645772 | 0.80 | PARP1 (0.40) | KMT2AMEN1PARP1MAPTHSP90AA1 |
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-113493438-B | Tetrahydroisoquinoline compounds | 南京再明医药有限公司 | 2023-10-20 | — | — | CN | disclosed |
| CN-113493438-A | Tetrahydroisoquinoline compounds | 江苏先声药业有限公司 | 2021-10-12 | — | — | CN | disclosed |