Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 5/20 | 0.44 |
| ▸ | ALAD | P13716 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.30 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.30 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.30 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.30 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.30 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.30 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.30 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28226219 | 0.88 | CTPS1 (0.36) | DAOKDM4EALDH1A1 | |
| SCHEMBL28167215 | 0.76 | DAO (0.33) | DAO | |
| SCHEMBL28053949 | 0.69 | MEN1 (0.39) | DAOKDM4EMEN1ALDH1A1MAPT | |
| SCHEMBL27819862 | 0.67 | CA12 (0.44) | KDM4EMEN1ALDH1A1MAPTKMT2A | |
| SCHEMBL27368331 | 0.66 | — | — | |
| SCHEMBL27294646 | 0.65 | HTT (0.43) | KDM4EMEN1ALDH1A1KMT2A | |
| SCHEMBL28848661 | 0.64 | PKM (0.38) | DAOALDH1A1 | |
| SCHEMBL7894090 | 0.63 | DAO (0.52) | DAOALADKDM4EMEN1ALDH1A1 | |
| SCHEMBL9430370 | 0.63 | DAO (0.43) | DAOALADKDM4EMEN1ALDH1A1 | |
| SCHEMBL28949829 | 0.63 | NPC1 (0.40) | MEN1ALDH1A1KMT2A |
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-105283443-B | Hete rocyclic derivatives and application thereof | 株式会社C&C新药研究所 | 2018-08-17 | — | — | CN | disclosed |
| CN-105283443-A | Heterocyclic derivatives and use thereof | C & C RES LAB | 2016-01-27 | — | — | CN | disclosed |