Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.82 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.82 |
| ▸ | LMNA | P02545 | 2/20 | 0.82 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.69 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.53 |
| ▸ | NAMPT | P43490 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.51 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.51 |
| ▸ | PLOD2 | O00469 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL27597233 | 1.00 | KMT2A (0.82) | KMT2ATDP1LMNASLC6A2SLC6A3 | |
| SCHEMBL290287 | 0.92 | TDP1 (0.85) | KMT2ATDP1LMNASLC6A2SLC6A3 | |
| Benzyl Nicotinate SCHEMBL24600 | 0.90 | LMNA (1.00) | KMT2ATDP1LMNASLC6A2SLC6A3 | |
| Benzyl Nicotinate SCHEMBL29394048 | 0.90 | LMNA (1.00) | KMT2ATDP1LMNASLC6A2SLC6A3 | |
| Benzyl Nicotinate SCHEMBL29080664 | 0.89 | LMNA (0.97) | KMT2ATDP1LMNASLC6A2SLC6A3 | |
| Benzyl Nicotinate SCHEMBL28041943 | 0.89 | LMNA (0.97) | KMT2ATDP1LMNASLC6A2SLC6A3 | |
| SCHEMBL11475708 | 0.86 | KMT2A (0.62) | KMT2ATDP1LMNASLC6A2SLC6A3 | |
| Benzyl Nicotinate SCHEMBL30432197 | 0.86 | TDP1 (0.91) | KMT2ATDP1LMNASLC6A2SLC6A3 | |
| Hydrochloric Acid SCHEMBL11473619 | 0.85 | KMT2A (0.61) | KMT2ATDP1LMNASLC6A2SLC6A3 | |
| Benzyl Nicotinate SCHEMBL22654538 | 0.84 | LMNA (0.86) | KMT2ATDP1LMNASLC6A2SLC6A3 |
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-115916748-A | Indole derivatives as alpha-1 antitrypsin modulators for the treatment of alpha-1 antitrypsin deficiency (AATD) | 弗特克斯药品有限公司 | 2023-04-04 | — | — | CN | disclosed |