Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.43 |
| ▸ | FDPS | P14324 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | IDH1 | O75874 | 1/20 | 0.37 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30455024 | 0.75 | MEN1 (0.45) | KMT2AMEN1FDPSOPRK1THRB | |
| SCHEMBL25482268 | 0.74 | ADRA2C (0.48) | KMT2AMEN1FDPSCYP2D6RAB9A | |
| Formic Acid SCHEMBL28415527 | 0.74 | MEN1 (0.47) | KMT2AMEN1FDPSOPRK1THRB | |
| SCHEMBL950300 | 0.73 | KMT2A (0.46) | KMT2AMEN1FDPSOPRK1KDM4E | |
| SCHEMBL6650433 | 0.73 | CASP6 (0.43) | KMT2AMEN1FDPSOPRK1KDM4E | |
| SCHEMBL6653570 | 0.72 | HSP90AA1 (0.46) | KMT2AMEN1FDPSOPRK1 | |
| SCHEMBL6651515 | 0.72 | KMT2A (0.48) | KMT2AMEN1HSPA5FDPSOPRK1 | |
| Formic Acid SCHEMBL2524899 | 0.71 | KMT2A (0.45) | KMT2AMEN1FDPSOPRK1TSHR | |
| SCHEMBL29194433 | 0.71 | ADRA2A (0.48) | KMT2AMEN1CYP2D6TSHR | |
| SCHEMBL1044189 | 0.71 | KMT2A (0.54) | KMT2AMEN1FDPSKDM4ETDP1 |
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-116143708-A | Polysubstituted benzazepine heteroaryl derivative and application thereof | 四川汇宇制药股份有限公司 | 2023-05-23 | — | — | CN | disclosed |