Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | GRM5 | P41594 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.44 |
| ▸ | LMNA | P02545 | 4/20 | 0.44 |
| ▸ | PKM | P14618 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.43 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.42 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.42 |
| ▸ | AOC3 | Q16853 | 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 | |
|---|---|---|---|---|
| SCHEMBL30604585 | 1.00 | MEN1 (0.47) | MEN1KMT2AGRM5TSHRCASP3 | |
| SCHEMBL28636452 | 0.91 | KMT2A (0.51) | MEN1KMT2AGRM5SMN1; SMN2LMNA | |
| SCHEMBL30604607 | 0.91 | KMT2A (0.51) | MEN1KMT2AGRM5SMN1; SMN2LMNA | |
| SCHEMBL28639031 | 0.90 | KMT2A (0.57) | MEN1KMT2ATSHRCASP3ALDH1A1 | |
| SCHEMBL28638924 | 0.83 | GRM5 (0.52) | MEN1KMT2AGRM5TSHRSMN1; SMN2 | |
| SCHEMBL30604584 | 0.83 | GRM5 (0.52) | MEN1KMT2AGRM5TSHRSMN1; SMN2 | |
| SCHEMBL28656587 | 0.82 | TSHR (0.51) | MEN1KMT2ATSHRCASP3SMN1; SMN2 | |
| SCHEMBL28638165 | 0.81 | MEN1 (0.57) | MEN1KMT2ATSHRCASP3SMN1; SMN2 | |
| SCHEMBL28633462 | 0.80 | KMT2A (0.53) | MEN1KMT2ACASP3MAPT | |
| SCHEMBL30604599 | 0.80 | MEN1 (0.53) | MEN1KMT2ATSHRCASP3SMN1; SMN2 |
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 |