Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 1/20 | 0.44 |
| ▸ | MC4R | P32245 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.42 |
| ▸ | PAICS | P22234 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.41 |
| ▸ | CHKA | P35790 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | NCF1 | P14598 | 1/20 | 0.41 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1126227 | 1.00 | LMNA (0.57) | LMNANR1H2LTA4HMC4RHRH3 | |
| SCHEMBL1126270 | 0.87 | GAA (0.49) | LMNAHRH3KDM4EGAAALDH1A1 | |
| SCHEMBL530048 | 0.84 | HRH3 (0.53) | LTA4HHRH3ALDH1A1 | |
| SCHEMBL15244569 | 0.84 | HRH3 (0.43) | LMNAHRH3KDM4EGAAALDH1A1 | |
| SCHEMBL14212815 | 0.81 | ALDH1A1 (0.53) | LMNAHRH3KDM4EALDH1A1KMT2A | |
| SCHEMBL12513 | 0.81 | LTA4H (0.45) | LMNALTA4HMC4RHRH3KDM4E | |
| SCHEMBL20160519 | 0.80 | MC4R (0.47) | LMNALTA4HMC4RHRH3PAICS | |
| SCHEMBL21565634 | 0.80 | LTA4H (0.44) | LMNALTA4HMC4RHRH3PAICS | |
| SCHEMBL3314825 | 0.80 | CXCR4 (0.45) | LMNAHRH3PAICSALDH1A1ADRA2C | |
| SCHEMBL30911535 | 0.80 | KDM4E (0.44) | LMNALTA4HMC4RHRH3PAICS |
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-116444488-A | Pyrimidine-2, 4-diamine derivative and preparation method and application thereof | 上海立森印迹医药技术有限公司 | 2023-07-18 | — | — | CN | disclosed |
| EP-3559000-B1 | BENZIMIDAZOLE DERIVATIVES, PREPARATION METHODS AND USES THEIROF | BETTA PHARMACEUTICALS CO LTD (CN) | 2022-03-23 | — | — | EP | disclosed |