Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 2/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | KDM6B | O15054 | 1/20 | 0.46 |
| ▸ | KDM5C | P41229 | 1/20 | 0.46 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.46 |
| ▸ | KDM3A | Q9Y4C1 | 1/20 | 0.46 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | PKM | P14618 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | JMJD6 | Q6NYC1 | 4/20 | 0.41 |
| ▸ | ABL1 | P00519 | 2/20 | 0.41 |
| ▸ | BCR | P11274 | 2/20 | 0.41 |
| ▸ | KMO | O15229 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29134646 | 0.86 | KDM1A (0.51) | KDM1AHDAC1ALDH1A1KMT2AKDM4C | |
| SCHEMBL29134657 | 0.86 | KMT2A (0.46) | KMT2AKDM4CKDM4EKDM6BKDM5C | |
| SCHEMBL28651256 | 0.85 | KAT6A (0.48) | ALDH1A1KMT2AKDM4CKDM4EKDM6B | |
| SCHEMBL29141517 | 0.84 | KDM4E (0.65) | KDM1AHDAC1KDM4CKDM4EKDM6B | |
| SCHEMBL4763737 | 0.81 | JMJD6 (0.61) | KDM1AHDAC1KDM4CKDM4EKDM6B | |
| SCHEMBL29932995 | 0.80 | MAP4K4 (0.54) | KDM1AHDAC1KMT2AKDM4CKDM5C | |
| Nitrous Acid SCHEMBL29134645 | 0.79 | KDM4C (0.59) | KDM1AHDAC1ALDH1A1KDM4CKDM4E | |
| SCHEMBL30775014 | 0.79 | KDM4C (0.64) | KDM1AHDAC1ALDH1A1KDM4CKDM4E | |
| SCHEMBL29163838 | 0.78 | SMYD2 (0.47) | ALDH1A1KMT2AKDM4CKDM4EKDM6B | |
| SCHEMBL27997808 | 0.74 | KDM4E (0.69) | KDM1AHDAC1ALDH1A1KDM4CKDM4E |
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-117343002-A | Synthesis method of beta-cyanoalkyl pyridine compound | 西南医科大学 | 2024-01-05 | — | — | CN | disclosed |