Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CDK1 | P06493 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | PDK1 | Q15118 | 9/20 | 0.34 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.34 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.34 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29131077 | 0.77 | MAP4K4 (0.45) | KDM4EMEN1KMT2APOLBL3MBTL1 | |
| SCHEMBL22544661 | 0.74 | BTK (0.43) | BTKMEN1KMT2APOLB | |
| SCHEMBL28532598 | 0.74 | LMNA (0.39) | MEN1CYP1A2KMT2ANPSR1TDP1 | |
| SCHEMBL16446429 | 0.73 | RARA (0.49) | KDM4EMEN1CYP1A2CYP3A4KMT2A | |
| SCHEMBL22097892 | 0.72 | CDH1 (0.45) | BTKKDM4EMEN1KMT2A | |
| SCHEMBL30437401 | 0.72 | KMT2A (0.50) | MEN1CYP1A2KMT2ANPSR1TDP1 | |
| SCHEMBL5385077 | 0.70 | MAP2K4 (0.47) | BTKKDM4EMEN1KMT2AKDR | |
| SCHEMBL30919628 | 0.70 | KDM4E (0.42) | BTKKDM4ECYP1A2CNR1L3MBTL1 | |
| SCHEMBL113937 | 0.70 | IDO1 (0.54) | MEN1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL10691581 | 0.70 | ALDH1A1 (0.51) | KDM4EMEN1KMT2ATDP1POLB |
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-117088851-A | Pyrimidine amine NUAK inhibitor and preparation method and application thereof | 特科罗生物科技(成都)有限公司 | 2023-11-21 | — | — | CN | disclosed |