Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 4/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL23927442 | 1.00 | KMT2A (0.38) | KMT2ALMNANPSR1KCNH2RXFP1 | |
| SCHEMBL23927464 | 0.89 | TSHR (0.46) | KMT2ANPSR1NPC1RAB9AMEN1 | |
| SCHEMBL23927454 | 0.88 | ALOX15 (0.45) | LMNAPDE3BPDE3ANPC1RAB9A | |
| SCHEMBL30091646 | 0.88 | ALOX15 (0.45) | LMNAPDE3BPDE3ANPC1RAB9A | |
| SCHEMBL30091508 | 0.86 | CHEK2 (0.35) | KMT2AMEN1 | |
| SCHEMBL22272869 | 0.86 | ALDH1A1 (0.43) | KMT2ALMNANPSR1KCNH2RXFP1 | |
| SCHEMBL30091681 | 0.86 | ALDH1A1 (0.43) | KMT2ALMNANPSR1KCNH2RXFP1 | |
| SCHEMBL23927463 | 0.85 | MMP13 (0.40) | KMT2ALMNANPSR1KCNH2RXFP1 | |
| SCHEMBL23927496 | 0.84 | KDM4E (0.40) | KMT2AMAPTMEN1HPGDALOX5 | |
| SCHEMBL23927502 | 0.84 | MMP2 (0.41) | KMT2ALMNANPSR1NPC1RAB9A |
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-113166116-B | Amido bridged heterocyclic compound, and composition and application thereof | 北京赛特明强医药科技有限公司 | 2022-12-27 | — | — | CN | disclosed |