Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 2/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | TACR1 | P25103 | 1/20 | 0.32 |
| ▸ | TACR3 | P29371 | 1/20 | 0.32 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | GAA | P10253 | 3/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29213867 | 0.90 | HTR6 (0.34) | HTR6CHRNB4CHRNA3MEN1KMT2A | |
| SCHEMBL29213845 | 0.70 | CA1 (0.38) | MEN1KMT2AALDH1A1KDM4E | |
| SCHEMBL3742265 | 0.66 | KMT2A (0.36) | MEN1KMT2AALDH1A1LMNAATM | |
| SCHEMBL29213766 | 0.65 | PARP1 (0.42) | ALDH1A1 | |
| SCHEMBL18030873 | 0.65 | PLA2G2A (0.53) | HTR6PLA2G2AALDH1A1KDM4EGAA | |
| SCHEMBL31474027 | 0.63 | CA12 (0.40) | KMT2AALDH1A1KDM4EGAALMNA | |
| SCHEMBL16709817 | 0.63 | SMN1; SMN2 (0.50) | MEN1KMT2AALDH1A1KDM4EGAA | |
| SCHEMBL23163640 | 0.62 | ALDH1A1 (0.41) | KMT2AALDH1A1KDM4EGAAATM | |
| SCHEMBL176858 | 0.62 | MAOB (0.59) | ALDH1A1LMNA | |
| SCHEMBL1484340 | 0.61 | KMT2A (0.54) | MEN1KMT2AALDH1A1KDM4EGAA |
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-118043314-A | Benzazepine heteroaromatic ring derivative and application thereof in medicine | 西藏海思科制药有限公司 | 2024-05-14 | — | — | CN | disclosed |
| WO-2023020566-A1 | BENZO NITROGEN-CONTAINING HETEROAROMATIC RING DERIVATIVE AND USE THEREOF IN MEDICINE | 四川海思科制药有限公司 | 2023-02-23 | — | — | WO | disclosed |